data_2fe9_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 2fe9 _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 ' 6' ' ' ASN . . . . . 0.457 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 110.739 -0.097 . . . . 1.72 110.739 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' THR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.76 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 2.0 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.547 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 1.17 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.562 HD22 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 1.19 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.481 HG23 ' O ' ' A' ' 7' ' ' PRO . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.83 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.452 ' CB ' ' HB3' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.524 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.93 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.666 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.17 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.41 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HZ1' ' HG ' ' A' ' 84' ' ' SER . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 1.55 110.03 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.493 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.81 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 1.04 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.17 110.34 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.575 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 1.14 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.666 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.13 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.17 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.72 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.78 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 1.51 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.562 HD21 HD22 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 1.0 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.51 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.98 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.522 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 1.51 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.72 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.45 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 1.43 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.532 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.93 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.508 ' HA ' HD13 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.76 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.18 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 1.07 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 1.51 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.651 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.86 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.12 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.611 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.25 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.528 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.85 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' HG21 ' A' ' 38' ' ' THR . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.14 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.3 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.491 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.91 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.4 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.505 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.558 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.57 HG22 HD21 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.92 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 1.51 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.616 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.63 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.651 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.75 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.643 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.54 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD11 HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.38 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.643 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.27 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 1.05 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 3.06 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 3.03 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.438 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.34 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.19 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.78 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.423 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.17 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.16 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.28 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.573 HG11 HG21 ' A' ' 44' ' ' ILE . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.17 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG12 HD13 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.29 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.523 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.93 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.598 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 2.2 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 3.05 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.523 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.598 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.25 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.421 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.85 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.467 ' HG ' ' HZ1' ' A' ' 17' ' ' LYS . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.58 110.035 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.452 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 8' ' ' LYS . 19.5 t-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.682 -0.118 . . . . 1.72 110.682 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.726 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.76 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.726 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 2.0 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 1.17 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.526 ' O ' HG22 ' A' ' 72' ' ' VAL . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 1.19 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.83 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.415 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.93 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.666 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.17 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.472 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.41 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 1.55 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.427 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.81 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 1.04 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.17 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.427 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 1.14 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.666 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.13 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.17 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.78 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 1.51 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.521 HD21 HD22 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 1.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.98 111.819 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.532 HD22 ' HE3' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 1.51 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.45 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.532 ' HE3' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 1.43 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.448 ' O ' HD11 ' A' ' 35' ' ' LEU . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.93 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.527 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.76 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.18 112.544 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.624 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 1.07 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.416 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 1.51 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.86 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.12 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.689 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.25 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.469 HD13 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.85 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 39' ' ' PRO . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.14 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.689 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.3 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.91 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.582 HD21 HG22 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.4 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.551 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.866 HG21 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.92 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.599 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 1.51 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.63 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.866 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.75 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.54 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.495 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.38 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.473 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.653 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.27 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.626 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 1.05 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.626 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 3.06 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 3.03 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.426 HD13 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.34 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.19 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.78 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.17 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.16 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.28 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.553 HG11 HG21 ' A' ' 44' ' ' ILE . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.17 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.748 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.29 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.93 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 2.2 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 3.05 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.25 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.448 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.458 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.85 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.58 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.537 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.602 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 18.8 m120 . . . . . 0 CA--C 1.528 0.131 0 N-CA-C 111.538 0.199 . . . . 1.72 111.538 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.514 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.76 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.604 ' HB3' ' HZ1' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 2.0 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.562 ' HG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 1.17 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.521 ' O ' HG22 ' A' ' 72' ' ' VAL . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 1.19 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.546 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.83 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.93 109.576 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.17 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.41 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.579 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 1.55 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.606 HD21 ' H ' ' A' ' 21' ' ' MET . 1.2 t30 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.81 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 1.04 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.17 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.606 ' H ' HD21 ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 1.14 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.685 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.13 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.17 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.78 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 1.51 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.507 HD11 HD22 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 1.0 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.98 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.491 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 1.51 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.45 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 1.43 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.93 110.369 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.467 ' HA ' HD13 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.76 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.18 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 1.07 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 1.51 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.569 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.86 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.525 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.12 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.636 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.25 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.649 HG13 ' HZ3' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.85 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.14 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.667 HG21 HG11 ' A' ' 72' ' ' VAL . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.3 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.47 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.91 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.508 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.4 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.503 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.505 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.889 HG21 ' HD3' ' A' ' 54' ' ' LYS . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.92 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.576 HD12 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 1.51 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.453 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.63 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.889 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.75 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.566 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.565 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.54 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.498 HD11 HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.38 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.521 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.565 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.27 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 1.05 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.566 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 3.06 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 3.03 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.34 110.647 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.19 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.434 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.78 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.17 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.16 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.28 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.667 HG11 HG21 ' A' ' 44' ' ' ILE . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.17 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.47 HG12 ' HE1' ' A' ' 45' ' ' TYR . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.29 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.472 ' CD2' HG22 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.93 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.649 ' HZ3' HG13 ' A' ' 41' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 2.2 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 3.05 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.546 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.25 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.459 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.85 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.49 ' HG ' ' HZ1' ' A' ' 17' ' ' LYS . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.58 109.723 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.448 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.533 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 110.449 -0.204 . . . . 1.72 110.449 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HD2' ' HZ2' ' A' ' 8' ' ' LYS . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.76 112.88 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HZ2' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 2.0 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 1.17 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 72' ' ' VAL . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 1.19 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.615 HG23 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.83 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.514 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.496 ' HZ2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.93 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.17 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.41 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HZ3' ' HB3' ' A' ' 84' ' ' SER . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 1.55 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.81 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.507 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 1.04 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.17 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.591 ' HE3' ' HG2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 1.14 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.604 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.13 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.17 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.739 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.78 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 1.51 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.443 ' HB3' HD13 ' A' ' 28' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 1.0 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.415 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.98 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 1.51 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.739 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.45 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 1.43 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.629 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.93 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.517 ' HA ' HD13 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.76 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.18 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.637 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 1.07 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 1.51 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.681 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.86 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.12 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.25 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.615 HG13 ' HZ1' ' A' ' 76' ' ' LYS . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.85 111.31 -179.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.637 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.14 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.635 HG21 HG11 ' A' ' 72' ' ' VAL . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.3 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.425 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.91 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.581 HD21 HG22 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.4 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.412 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.581 HG22 HD21 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.92 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 1.51 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.532 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.63 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.681 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.75 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.629 ' HB3' ' HH ' ' A' ' 31' ' ' TYR . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.54 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.464 HD13 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.38 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.27 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.618 ' HA ' HD12 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 1.05 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.552 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 3.06 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 3.03 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.34 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.19 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.583 ' HZ1' HD13 ' A' ' 71' ' ' ILE . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.78 109.024 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.539 ' HA ' HD12 ' A' ' 71' ' ' ILE . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.444 ' HE1' HD13 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.17 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.16 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.583 HD13 ' HZ1' ' A' ' 67' ' ' LYS . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.28 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.635 HG11 HG21 ' A' ' 44' ' ' ILE . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.17 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.425 HG12 ' HE1' ' A' ' 45' ' ' TYR . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.29 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.615 ' HB2' HG23 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.93 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.615 ' HZ1' HG13 ' A' ' 41' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 2.2 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 3.05 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.404 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.529 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.25 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.441 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.458 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.85 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.568 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.58 109.84 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.429 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.539 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 110.836 -0.061 . . . . 1.72 110.836 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.479 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.76 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.559 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 2.0 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 1.17 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 1.19 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.488 HG22 ' CD2' ' A' ' 75' ' ' TYR . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.83 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.439 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.6 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.93 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.17 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.468 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.41 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HZ1' ' HB3' ' A' ' 84' ' ' SER . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 1.55 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.439 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.81 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 1.04 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.17 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.6 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 1.14 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.13 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.17 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.78 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 1.51 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.98 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.565 ' HA ' ' HG2' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 1.51 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.45 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 1.43 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.457 ' CD2' HG11 ' A' ' 56' ' ' VAL . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.93 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.515 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.76 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.18 112.467 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.563 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 1.07 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.613 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 1.51 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.591 ' HG1' ' HZ2' ' A' ' 54' ' ' LYS . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.86 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.486 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.12 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.638 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.25 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.425 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.85 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.553 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.14 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.3 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.459 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.91 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.637 HD21 HG22 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.4 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.485 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.637 HG22 HD21 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.92 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 1.51 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.63 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.591 ' HZ2' ' HG1' ' A' ' 38' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.75 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.54 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.468 HD11 HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.38 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.27 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.646 ' HA ' HD12 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 1.05 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 3.06 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 3.03 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.34 110.661 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.19 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.491 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.78 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.448 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.17 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.16 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.28 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.541 HG11 HG21 ' A' ' 44' ' ' ILE . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.17 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.489 HG12 HD13 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.29 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.493 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.93 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 2.2 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 3.05 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.493 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.25 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.85 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.546 ' HB3' ' HZ1' ' A' ' 17' ' ' LYS . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.58 109.975 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.424 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.5 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.713 -0.106 . . . . 1.72 110.713 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HD2' ' HZ1' ' A' ' 8' ' ' LYS . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.76 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HZ1' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 2.0 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.468 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 1.17 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.616 ' O ' HG22 ' A' ' 72' ' ' VAL . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 1.19 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.478 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.83 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.478 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.93 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.651 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.17 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.41 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HZ3' ' HB3' ' A' ' 84' ' ' SER . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 1.55 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.81 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 1.04 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.17 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.478 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 1.14 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.13 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.17 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.78 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 1.51 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 1.0 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.505 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.98 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 1.51 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.45 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 1.43 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.467 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.93 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 36' ' ' SER . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.76 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.18 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.623 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 1.07 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 1.51 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.86 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.12 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.599 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.25 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.719 HD12 ' HZ3' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.85 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB2' HG21 ' A' ' 38' ' ' THR . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.623 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.14 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.688 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.3 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.434 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.91 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.577 HD22 HG22 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.4 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.577 HG22 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.92 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.616 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 1.51 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.493 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.63 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.75 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.616 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.416 HD13 ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.54 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' NH2' ' A' ' 62' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.38 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.602 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.597 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.27 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.557 ' HA ' HD12 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 1.05 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 3.06 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 3.03 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.409 ' HG ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.34 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.19 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.467 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.78 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.403 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.17 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.16 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.28 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.688 HG11 HG21 ' A' ' 44' ' ' ILE . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.17 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.507 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.29 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.496 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.93 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.719 ' HZ3' HD12 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 2.2 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 3.05 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.567 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.25 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.447 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.85 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.497 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.58 110.054 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.451 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.458 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 111.148 0.055 . . . . 1.72 111.148 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HZ2' ' A' ' 8' ' ' LYS . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.76 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.565 ' HZ2' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 2.0 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 1.17 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HG22 ' A' ' 72' ' ' VAL . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 1.19 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.593 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.83 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.447 ' HE2' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.93 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.17 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 13' ' ' PRO . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.41 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.583 ' HZ2' ' HG ' ' A' ' 84' ' ' SER . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 1.55 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.81 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 1.04 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.17 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 1.14 109.568 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.647 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.13 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.17 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.78 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 1.51 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.416 HD21 HD22 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 1.0 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.98 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.572 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 1.51 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.45 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HE3' HD22 ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 1.43 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CD2' HG11 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.93 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.453 ' HA ' HD13 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.76 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.18 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 1.07 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 1.51 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.613 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.86 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.12 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.643 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.25 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.85 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB2' HG21 ' A' ' 38' ' ' THR . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.518 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.14 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.3 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.456 ' HE1' ' HZ2' ' A' ' 76' ' ' LYS . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.91 111.215 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.515 HD22 HG22 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.4 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.472 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.482 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.92 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.742 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 1.51 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.472 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.448 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.63 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.75 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.742 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.54 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.52 HD11 HH21 ' A' ' 62' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.38 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.27 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.52 HH21 HD11 ' A' ' 59' ' ' LEU . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 1.05 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 3.06 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 3.03 111.293 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.34 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.19 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.78 108.929 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.447 ' O ' ' HB ' ' A' ' 44' ' ' ILE . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.17 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.16 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.28 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.61 HG22 ' O ' ' A' ' 10' ' ' LEU . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.17 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.29 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.44 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.93 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.482 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 2.2 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 3.05 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.42 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.593 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.25 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.429 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.85 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.583 ' HG ' ' HZ2' ' A' ' 17' ' ' LYS . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.58 110.378 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.498 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.444 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.465 0.172 . . . . 1.72 111.465 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HD2' ' HZ3' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.76 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HZ3' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 2.0 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.421 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 1.17 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.571 ' O ' HG22 ' A' ' 72' ' ' VAL . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 1.19 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.475 HG22 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.83 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.93 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.17 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.41 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 1.55 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.81 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 1.04 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.17 111.323 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.437 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 1.14 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.701 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.13 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.515 HD13 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.17 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.78 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 1.51 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.508 HD21 HD22 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.454 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.98 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.514 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 1.51 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.438 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.45 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 1.43 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.431 ' CD2' HG11 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.93 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.515 ' HA ' HD13 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.76 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.18 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 1.07 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 1.51 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.86 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.12 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.606 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.25 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.6 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.85 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.463 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.65 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.14 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.672 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.3 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.91 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.646 HD21 HG22 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.4 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.505 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.646 HG22 HD21 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.92 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 1.51 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.486 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.63 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.51 ' HG3' HD13 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.75 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.608 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.543 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.54 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.505 HD11 HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.38 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.27 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 1.05 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.575 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 3.06 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 3.03 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.34 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.19 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.478 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.78 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.427 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.17 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.16 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.28 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.672 HG11 HG21 ' A' ' 44' ' ' ILE . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.17 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.505 HG12 HD13 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.29 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.93 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.6 ' HZ1' HD13 ' A' ' 41' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 2.2 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 3.05 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.519 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.25 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.45 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.85 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.58 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.405 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 111.461 0.171 . . . . 1.72 111.461 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' O ' HG23 ' A' ' 11' ' ' THR . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.76 112.396 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 2.0 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 1.17 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 72' ' ' VAL . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 1.19 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.517 ' HB ' HG12 ' A' ' 81' ' ' ILE . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.83 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.93 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.17 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 12' ' ' ASP . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.41 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 1.55 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.453 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.81 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 1.04 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.17 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.538 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 1.14 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.608 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.13 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.17 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.78 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 1.51 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.505 HD11 HD22 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 1.0 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.98 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.538 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 1.51 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.457 ' H ' ' HD1' ' A' ' 29' ' ' HIS . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.45 107.112 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HE3' HD22 ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 1.43 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE2' ' HD2' ' A' ' 30' ' ' LYS . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.93 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.45 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.76 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.18 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 1.07 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 1.51 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.569 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.86 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.12 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.616 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.25 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.502 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.85 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HB2' HG21 ' A' ' 38' ' ' THR . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.582 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.14 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.3 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.451 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.91 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.712 HD12 ' NZ ' ' A' ' 54' ' ' LYS . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.4 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.466 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.92 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.689 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 1.51 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.5 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.63 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.712 ' NZ ' HD12 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.75 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.689 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.455 HD13 ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.62 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.54 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.497 HD23 ' NH2' ' A' ' 62' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.38 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.62 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.27 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.603 ' HA ' HD12 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 1.05 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 3.06 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 3.03 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.436 ' HG ' HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.34 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.19 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.78 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.17 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.28 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 10' ' ' LEU . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.17 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.508 HG12 HD13 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.29 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.454 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.93 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.586 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 2.2 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 3.05 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.415 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.25 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.432 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.503 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.85 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.58 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.419 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.709 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.76 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.709 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 2.0 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 1.17 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.56 HD23 HD23 ' A' ' 26' ' ' LEU . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 1.19 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.83 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.459 ' CB ' ' HB3' ' A' ' 85' ' ' ALA . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.432 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.93 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.17 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.473 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.41 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HZ2' ' HG ' ' A' ' 84' ' ' SER . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 1.55 110.078 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.478 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.81 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 1.04 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.433 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.17 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 1.14 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.687 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.13 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.533 HD22 HD13 ' A' ' 26' ' ' LEU . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.17 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.78 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 1.51 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.572 ' HB2' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 1.0 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.477 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.98 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 1.51 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.45 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 1.43 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.561 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.93 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.523 ' HA ' HD13 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.76 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.444 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.18 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 1.07 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.433 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 1.51 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.595 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.86 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.12 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.645 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.25 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.484 HG13 ' HZ1' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.85 111.005 -179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HB2' HG21 ' A' ' 38' ' ' THR . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.577 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.14 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.645 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.3 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.416 ' H ' ' C ' ' A' ' 43' ' ' LEU . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.91 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.4 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.92 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 1.51 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.56 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.63 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.75 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.653 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.54 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.38 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 64' ' ' LYS . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.611 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.27 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.56 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 1.05 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.583 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 3.06 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 60' ' ' GLY . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 3.03 111.455 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.554 HD11 HD21 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.34 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.19 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.78 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.454 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.17 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.16 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.28 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.617 HG11 HG21 ' A' ' 44' ' ' ILE . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.17 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.432 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.29 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.531 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.93 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.599 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 2.2 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 3.05 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.531 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.599 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.25 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.423 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.85 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.566 ' HG ' ' HZ2' ' A' ' 17' ' ' LYS . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.58 109.857 179.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.459 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.536 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.623 0.249 . . . . 1.72 111.133 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.76 113.257 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 2.0 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.512 ' HG ' ' HG ' ' A' ' 25' ' ' SER . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 1.17 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.605 ' O ' HG22 ' A' ' 72' ' ' VAL . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 1.19 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.525 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.83 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.488 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.462 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.93 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.17 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.529 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.41 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 1.55 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.81 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 35' ' ' LEU . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 1.04 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.17 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 1.14 109.52 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.13 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' A' ' 35' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.17 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.78 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.512 ' HG ' ' HG ' ' A' ' 9' ' ' SER . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 1.51 110.273 179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.5 ' HB3' HD13 ' A' ' 28' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 1.0 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.98 111.002 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 26' ' ' LEU . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 1.51 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.45 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 1.43 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.434 ' CD2' HG11 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.93 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.76 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.18 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 1.07 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 1.51 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.447 HG21 ' HB2' ' A' ' 42' ' ' GLU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.86 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.45 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.12 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.25 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.488 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.85 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HB2' HG21 ' A' ' 38' ' ' THR . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.14 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.3 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.91 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.4 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.426 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.537 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.603 HG22 HD21 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.92 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.648 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 1.51 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.63 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.75 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.648 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.431 ' HB2' ' CB ' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.54 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.549 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.38 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.27 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 1.05 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 3.06 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 3.03 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.401 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.34 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.19 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.78 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.457 ' HE1' HD13 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.17 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.16 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.28 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 10' ' ' LEU . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.17 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG12 HD13 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.29 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.687 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.93 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.58 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 2.2 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 3.05 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.553 HD12 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.25 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.438 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.432 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.85 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.58 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.486 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.432 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.575 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 16.0 m120 . . . . . 0 CA--C 1.531 0.221 0 N-CA-C 111.347 0.128 . . . . 1.72 111.347 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.487 ' O ' HG23 ' A' ' 11' ' ' THR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.76 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.61 ' HB3' ' HZ1' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 2.0 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.427 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 1.17 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 72' ' ' VAL . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 1.19 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.527 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.83 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.403 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.93 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.677 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.17 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.516 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.41 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 1.55 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.558 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.81 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 1.04 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.473 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.17 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.558 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 1.14 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.677 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.13 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.533 HD13 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.17 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.78 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 1.51 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 HD22 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 1.0 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.98 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 30' ' ' LYS . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 1.51 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.45 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 1.43 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.421 ' CD2' HG11 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.93 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.533 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.76 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.422 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.18 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 1.07 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 1.51 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.86 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.12 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.583 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.25 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.695 HD12 ' HZ1' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.85 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HB2' HG21 ' A' ' 38' ' ' THR . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.14 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.678 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.3 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.441 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.91 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.4 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.513 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.481 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.883 HG21 ' HD3' ' A' ' 54' ' ' LYS . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.92 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.692 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 1.51 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.63 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.883 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.75 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD12 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.509 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.698 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.54 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.534 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.38 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.698 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.27 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.542 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 1.05 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 3.06 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 3.03 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.34 110.579 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.19 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.78 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.446 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.424 ' HE1' HD13 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.17 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.16 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.28 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.17 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.484 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.29 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.93 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.695 ' HZ1' HD12 ' A' ' 41' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 2.2 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 3.05 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.508 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.527 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.448 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.85 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.58 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.445 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 111.831 0.308 . . . . 1.72 111.831 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.679 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.76 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.679 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 2.0 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 1.17 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.548 ' HA ' ' HE1' ' A' ' 22' ' ' TRP . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 1.19 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.552 HG23 ' O ' ' A' ' 7' ' ' PRO . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.83 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.463 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.611 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.93 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.17 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.41 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 1.55 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.81 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 1.04 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.422 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.17 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.611 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 1.14 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.63 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.13 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.17 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.78 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 1.51 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.501 HD21 HD22 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.98 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.567 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 1.51 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.45 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 1.43 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.473 ' CD2' HG11 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.93 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.541 ' HA ' HD13 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.76 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.18 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 1.07 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.51 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.86 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.12 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.671 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.25 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.85 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HB2' HG21 ' A' ' 38' ' ' THR . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.14 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.671 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.3 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.91 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.549 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.4 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.476 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.52 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.87 HG21 ' HD3' ' A' ' 54' ' ' LYS . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.92 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.691 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 1.51 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.591 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.63 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.75 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.691 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.54 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.462 HD11 HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.38 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.27 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.591 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 1.05 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.573 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 3.06 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 3.03 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.535 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.34 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.19 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.439 ' HE2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.78 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.17 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.16 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.28 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 44' ' ' ILE . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.17 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.735 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.29 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.503 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.93 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.735 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 2.2 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 3.05 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.503 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.543 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.25 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.46 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.85 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.58 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.463 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.538 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 111.322 0.119 . . . . 1.72 111.322 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.76 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 2.0 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.466 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 1.17 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.557 ' O ' HG22 ' A' ' 72' ' ' VAL . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 1.19 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.521 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.83 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.526 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.495 ' HZ2' ' HG3' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.93 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.618 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.17 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.41 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.526 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 1.55 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.532 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.81 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 1.04 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.411 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.17 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.574 ' HE3' ' HG3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 1.14 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.618 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.13 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.17 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HG3' ' HE3' ' A' ' 21' ' ' MET . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.78 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 1.51 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.503 HD21 HD22 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 1.0 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.98 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.685 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 1.51 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.478 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.45 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.685 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 1.43 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.42 ' CE1' ' HA ' ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.93 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.478 ' OG ' ' HA ' ' A' ' 29' ' ' HIS . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.76 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.437 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.18 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 1.07 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 1.51 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.86 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.12 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.684 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.25 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.526 HD13 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.85 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.45 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.653 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.14 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.3 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.91 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.609 HD21 HG22 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.4 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.576 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.572 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.869 HG21 ' HD3' ' A' ' 54' ' ' LYS . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.92 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.67 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 1.51 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.587 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.453 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.63 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.869 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.75 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.67 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.528 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.54 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.479 HD23 HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.38 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.531 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.27 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.587 HH11 ' HB2' ' A' ' 52' ' ' GLU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 1.05 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 3.06 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 3.03 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.446 HD21 HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.34 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.19 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.484 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.78 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.479 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.17 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.16 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.28 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.604 HG11 HG21 ' A' ' 44' ' ' ILE . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.17 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.767 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.29 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.512 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.93 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.767 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 2.2 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 3.05 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.512 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.25 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.458 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.432 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.85 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.58 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.473 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.453 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.135 0.017 . . . . 1.72 110.976 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.725 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.76 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 2.0 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 1.17 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.557 ' O ' HG22 ' A' ' 72' ' ' VAL . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 1.19 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.475 HG23 ' O ' ' A' ' 7' ' ' PRO . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.83 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.565 ' HZ2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.93 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.17 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.41 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 1.55 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.81 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 1.04 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.439 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.17 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.565 ' HG2' ' HZ2' ' A' ' 14' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 1.14 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.13 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.17 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.78 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 1.51 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.487 HD21 HD12 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 1.0 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.426 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.98 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.554 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 1.51 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.457 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.45 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 1.43 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.93 110.88 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' HD13 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.76 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.18 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 1.07 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 1.51 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.558 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.86 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.494 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.12 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.642 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.25 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.421 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.85 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.14 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.3 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.91 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.4 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.468 ' HA ' HD21 ' A' ' 66' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.567 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.519 HG22 HD21 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.92 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.609 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 1.51 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.526 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.521 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.63 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.75 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.609 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.54 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.462 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.38 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.27 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.567 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 1.05 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.562 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 3.06 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 3.03 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.34 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.19 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.544 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.78 108.961 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.17 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.16 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.28 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 44' ' ' ILE . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.17 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.52 HG12 HD13 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.29 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.44 ' CD2' HG22 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.93 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 2.2 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 3.05 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.558 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.25 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.412 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.59 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.85 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.58 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.505 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.442 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 . . . . . 0 C--O 1.226 -0.181 0 N-CA-C 110.778 -0.082 . . . . 1.72 110.778 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.76 112.423 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.528 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 2.0 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.446 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 1.17 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.577 ' O ' HG22 ' A' ' 72' ' ' VAL . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 1.19 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.83 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.688 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.93 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.17 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.41 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 84' ' ' SER . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 1.55 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.81 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 1.04 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.421 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.17 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.688 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 1.14 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.595 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.13 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.17 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.78 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 1.51 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 1.0 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.98 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.621 HD21 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 1.51 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.45 107.201 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.621 ' HE3' HD21 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 1.43 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.566 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.93 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 36' ' ' SER . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.76 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.444 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.18 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 1.07 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 1.51 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.618 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.86 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.12 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.638 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.25 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.85 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.14 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.3 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.447 ' HE1' ' HZ1' ' A' ' 76' ' ' LYS . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.91 111.37 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.51 HD21 HG22 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.4 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.527 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.92 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.665 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 1.51 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.567 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.471 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.63 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.618 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.75 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.665 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.54 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.38 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.27 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 1.05 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.537 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 3.06 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 3.03 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.34 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.19 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.78 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.17 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.16 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.28 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.579 HG11 HG21 ' A' ' 44' ' ' ILE . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.17 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.514 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.29 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.495 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 2.2 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.428 ' O ' HD13 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 3.05 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 78' ' ' ARG . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.25 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.442 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.85 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.601 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.58 110.129 179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.452 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.488 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 110.464 -0.198 . . . . 1.72 110.464 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.745 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.76 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 2.0 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.43 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 1.17 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.54 ' O ' HG22 ' A' ' 72' ' ' VAL . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 1.19 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 7' ' ' PRO . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.83 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.65 ' HZ3' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.93 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.17 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.41 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.517 ' HZ2' ' HB3' ' A' ' 84' ' ' SER . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 1.55 110.147 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.81 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 1.04 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.17 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.65 ' HG2' ' HZ3' ' A' ' 14' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 1.14 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.624 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.13 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.537 HD13 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.17 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.78 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 1.51 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.69 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 1.0 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.98 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.567 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 1.51 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.601 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.45 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 1.43 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.489 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.93 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.537 ' HA ' HD13 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.76 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.405 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.18 112.488 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.596 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 1.07 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 1.51 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.86 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.12 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.636 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.25 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.453 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.85 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HB2' HG21 ' A' ' 38' ' ' THR . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.596 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.14 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.3 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.481 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.91 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.625 HD22 HG22 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.4 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.421 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.513 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.884 HG21 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.92 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.652 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 1.51 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.496 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.63 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.884 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.75 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.652 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.455 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.549 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.54 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.38 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.27 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.571 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 1.05 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 3.06 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 3.03 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.34 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.19 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.78 108.813 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.17 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.16 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.28 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.622 HG11 HG21 ' A' ' 44' ' ' ILE . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.17 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.52 HG12 HD13 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.29 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.43 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.93 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.493 ' HB2' HD12 ' A' ' 81' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 2.2 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 3.05 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.493 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.25 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.446 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.438 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.85 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.517 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.58 109.742 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.438 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.458 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.2 m120 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 119.986 -0.054 . . . . 1.72 110.887 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' O ' HG23 ' A' ' 11' ' ' THR . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.76 111.885 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 2.0 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 1.17 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 72' ' ' VAL . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 1.19 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.519 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.83 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.534 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.449 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.93 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.637 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.17 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.41 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 1.55 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.81 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 1.04 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.17 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 1.14 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.637 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.13 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.17 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.78 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 1.51 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.444 HD11 HD22 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 1.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.98 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 1.51 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.519 ' HE3' HD22 ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 1.43 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.461 ' O ' HD11 ' A' ' 35' ' ' LEU . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.93 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' HD13 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.76 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.431 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.18 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.624 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 1.07 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.481 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 1.51 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.422 HG21 ' HB2' ' A' ' 42' ' ' GLU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.86 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.12 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.25 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.85 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB2' HG21 ' A' ' 38' ' ' THR . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.501 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.14 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.7 HD12 ' HZ2' ' A' ' 76' ' ' LYS . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.3 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.496 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.91 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.594 HD21 HG22 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.4 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.497 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.494 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.886 HG21 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.92 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.599 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 1.51 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.63 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.886 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.75 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.54 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.514 HD11 HH21 ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.38 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.633 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.27 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 1.05 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 3.06 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.565 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 3.03 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 HD13 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.34 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.19 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HZ1' HD13 ' A' ' 71' ' ' ILE . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.78 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.553 ' HA ' HD12 ' A' ' 71' ' ' ILE . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.17 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.16 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.553 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.28 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.626 HG11 HG21 ' A' ' 44' ' ' ILE . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.17 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.7 ' HA ' ' HZ3' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.29 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.453 ' CD2' HG22 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.93 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.7 ' HZ2' HD12 ' A' ' 44' ' ' ILE . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 2.2 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 3.05 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.556 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.25 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.85 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.58 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.531 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.459 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.452 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 111.058 0.022 . . . . 1.72 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.523 ' O ' HG23 ' A' ' 11' ' ' THR . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.76 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 2.0 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.548 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 1.17 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.51 ' HB3' HG22 ' A' ' 72' ' ' VAL . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 1.19 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' PRO . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.83 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.441 ' HA ' HD13 ' A' ' 16' ' ' LEU . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.542 ' HZ3' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.93 109.312 179.354 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.669 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.17 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.41 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 1.55 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.81 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.603 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 1.04 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.479 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.17 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.542 ' HG2' ' HZ3' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 1.14 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.669 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.13 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.17 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.483 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.78 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 1.51 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.547 ' C ' ' HD2' ' A' ' 27' ' ' ARG . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 1.0 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.547 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.98 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.535 HD22 ' HB1' ' A' ' 61' ' ' ALA . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 1.51 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.45 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 1.43 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.462 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.93 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.487 ' HA ' HD13 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.76 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB1' ' N ' ' A' ' 55' ' ' GLY . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.18 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.631 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 1.07 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.479 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 1.51 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.603 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.86 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.12 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.615 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.25 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.487 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.85 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 38' ' ' THR . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.631 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.14 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.3 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.451 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.91 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.4 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.495 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.496 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.893 HG21 ' HD3' ' A' ' 54' ' ' LYS . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.92 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.605 HD12 ' HA ' ' A' ' 62' ' ' ARG . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 1.51 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.524 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.63 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.75 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.416 ' N ' ' HB1' ' A' ' 34' ' ' ALA . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.416 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.54 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.448 HD11 HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.38 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.27 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HA ' HD12 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 1.05 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.563 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 3.06 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 3.03 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.475 ' HB2' HD12 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.34 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.19 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.78 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.17 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.16 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.28 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.583 HG11 HG21 ' A' ' 44' ' ' ILE . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.17 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.483 HG12 HD13 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.29 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.513 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.93 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.603 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 2.2 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 3.05 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.603 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.25 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.436 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.85 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.58 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.42 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 111.286 0.106 . . . . 1.72 111.286 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.697 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.76 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.697 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 2.0 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.513 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 1.17 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.597 HD22 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 1.19 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.514 HG23 ' O ' ' A' ' 7' ' ' PRO . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.83 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.521 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.419 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.93 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.695 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.17 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.41 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 1.55 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.449 ' HB3' ' HB2' ' A' ' 21' ' ' MET . 0.8 OUTLIER -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.81 109.225 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.544 HD11 ' HA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 1.04 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.17 110.983 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.522 ' HB3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 1.14 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.695 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.13 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.465 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.17 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.78 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 1.51 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.597 HD21 HD22 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.483 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.98 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.51 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 1.51 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.491 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.45 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HE2' ' O ' ' A' ' 27' ' ' ARG . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 1.43 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.458 ' CD2' HG11 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.93 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.491 ' OG ' ' HA ' ' A' ' 29' ' ' HIS . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.76 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.18 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 1.07 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 1.51 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.53 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.86 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.12 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.637 ' HZ3' ' NZ ' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.25 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.85 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' HG21 ' A' ' 38' ' ' THR . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.14 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.666 HD12 ' HZ3' ' A' ' 76' ' ' LYS . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.3 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.91 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.4 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.501 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.573 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.597 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.92 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.628 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 1.51 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.63 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.75 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.628 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.421 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.54 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.38 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.625 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.27 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.573 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 1.05 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.544 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 3.06 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 3.03 110.713 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.34 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.533 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.19 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.78 108.746 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.488 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.17 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.16 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.28 110.951 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.508 HG11 HG21 ' A' ' 44' ' ' ILE . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.17 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.677 ' HA ' ' HZ1' ' A' ' 76' ' ' LYS . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.29 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.93 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.677 ' HZ1' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 2.2 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 3.05 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.538 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.599 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.25 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.85 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.58 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.52 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.404 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 120.839 0.352 . . . . 5.65 110.928 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.469 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 27.8 t-20 -91.85 -77.39 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 4.09 110.818 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.3 p 45.77 55.31 6.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.077 -0.51 . . . . 2.29 111.271 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.9 t -100.21 9.38 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 2.27 110.972 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.552 ' HE2' ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER 56.56 85.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.004 -0.544 . . . . 1.22 111.22 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.457 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 -79.89 108.14 8.43 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 1.72 110.739 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.481 ' O ' HG23 ' A' ' 11' ' ' THR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.76 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 2.0 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.547 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 1.17 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.562 HD22 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 1.19 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.481 HG23 ' O ' ' A' ' 7' ' ' PRO . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.83 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.452 ' CB ' ' HB3' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.524 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.93 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.666 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.17 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.41 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HZ1' ' HG ' ' A' ' 84' ' ' SER . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 1.55 110.03 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.493 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.81 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 1.04 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.17 110.34 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.575 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 1.14 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.666 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.13 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.17 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.72 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.78 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 1.51 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.562 HD21 HD22 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 1.0 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.51 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.98 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.522 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 1.51 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.72 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.45 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 1.43 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.532 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.93 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.508 ' HA ' HD13 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.76 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.18 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 1.07 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 1.51 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.651 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.86 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.12 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.611 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.25 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.528 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.85 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB2' HG21 ' A' ' 38' ' ' THR . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.14 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.3 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.491 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.91 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.582 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.4 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.505 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.558 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.57 HG22 HD21 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.92 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.632 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 1.51 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.616 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.63 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.651 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.75 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.632 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.643 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.54 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD11 HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.38 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.643 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.27 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.616 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 1.05 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 3.06 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.463 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 3.03 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.438 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.34 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.19 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.78 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.552 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.17 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.16 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.28 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.573 HG11 HG21 ' A' ' 44' ' ' ILE . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.17 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG12 HD13 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.29 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.523 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.93 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.598 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 2.2 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 3.05 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.523 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.598 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.25 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.421 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.85 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.467 ' HG ' ' HZ1' ' A' ' 17' ' ' LYS . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.58 110.035 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.452 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.478 ' HG ' ' H ' ' A' ' 2' ' ' ASN . 79.7 p . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.82 0.343 . . . . 5.65 110.903 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.478 ' H ' ' HG ' ' A' ' 1' ' ' SER . 8.4 p30 -164.6 135.67 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 4.09 110.837 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.597 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 30.8 t -73.08 84.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.163 -0.471 . . . . 2.29 110.961 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.4 t -136.9 8.54 3.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 2.27 110.748 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.471 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.2 OUTLIER 58.53 71.01 0.61 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.189 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 8' ' ' LYS . 19.5 t-20 -72.3 107.87 3.54 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.04 -0.527 . . . . 1.72 110.682 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.726 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.76 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.726 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 2.0 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 1.17 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.526 ' O ' HG22 ' A' ' 72' ' ' VAL . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 1.19 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.51 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.83 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.415 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.93 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.666 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.17 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.472 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.41 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 1.55 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.427 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.81 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 1.04 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.17 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.427 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 1.14 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.666 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.13 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.17 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.78 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 1.51 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.521 HD21 HD22 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 1.0 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.597 ' HB2' ' HB2' ' A' ' 3' ' ' SER . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.98 111.819 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.532 HD22 ' HE3' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 1.51 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.45 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.532 ' HE3' HD22 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 1.43 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.448 ' O ' HD11 ' A' ' 35' ' ' LEU . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.93 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.527 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.76 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.18 112.544 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.624 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 1.07 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.416 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 1.51 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.86 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.12 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.689 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.25 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.469 HD13 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.85 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 39' ' ' PRO . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.14 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.689 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.3 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.91 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.582 HD21 HG22 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.4 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.551 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.866 HG21 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.92 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.599 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 1.51 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.63 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.866 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.75 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.54 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.495 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.38 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.473 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.653 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.27 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.626 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 1.05 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.626 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 3.06 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 3.03 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.426 HD13 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.34 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.19 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.78 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.433 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.507 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.17 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.16 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.28 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.553 HG11 HG21 ' A' ' 44' ' ' ILE . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.17 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.748 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.29 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.93 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.748 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 2.2 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 3.05 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.25 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.448 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.458 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.85 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.58 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.537 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 5.65 110.863 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.506 ' N ' HD21 ' A' ' 2' ' ' ASN . 0.1 OUTLIER -162.78 20.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 4.09 111.074 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.48 ' HB2' ' HG3' ' A' ' 27' ' ' ARG . 24.5 t 61.59 -82.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.137 -0.483 . . . . 2.29 110.919 -179.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.4 m 61.26 99.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 2.27 111.334 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.508 ' O ' ' HD3' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -59.02 99.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 1.22 110.26 179.429 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.602 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 18.8 m120 -84.19 106.17 7.5 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 1.72 111.538 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.514 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.76 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.604 ' HB3' ' HZ1' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 2.0 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.562 ' HG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 1.17 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.521 ' O ' HG22 ' A' ' 72' ' ' VAL . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 1.19 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.546 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.83 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.93 109.576 179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.17 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.41 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.579 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 1.55 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.606 HD21 ' H ' ' A' ' 21' ' ' MET . 1.2 t30 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.81 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 1.04 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.17 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.606 ' H ' HD21 ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 1.14 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.685 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.13 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.17 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.78 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 1.51 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.507 HD11 HD22 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 1.0 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.48 ' HG3' ' HB2' ' A' ' 3' ' ' SER . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.98 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.491 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 1.51 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.45 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 1.43 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.93 110.369 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.467 ' HA ' HD13 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.76 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.18 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 1.07 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 1.51 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.569 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.86 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.525 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.12 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.636 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.25 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.649 HG13 ' HZ3' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.85 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.14 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.667 HG21 HG11 ' A' ' 72' ' ' VAL . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.3 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.47 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.91 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.508 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.4 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.503 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.505 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.889 HG21 ' HD3' ' A' ' 54' ' ' LYS . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.92 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.576 HD12 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 1.51 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.453 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.63 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.889 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.75 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.566 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.565 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.54 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.498 HD11 HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.38 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.521 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.565 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.27 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 1.05 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.566 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 3.06 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 3.03 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.34 110.647 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.19 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.434 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.78 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.502 ' HB3' ' HG3' ' A' ' 5' ' ' MET . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.17 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.16 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.28 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.667 HG11 HG21 ' A' ' 44' ' ' ILE . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.17 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.47 HG12 ' HE1' ' A' ' 45' ' ' TYR . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.29 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.472 ' CD2' HG22 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.93 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.649 ' HZ3' HG13 ' A' ' 41' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 2.2 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 3.05 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.546 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.25 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.459 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.85 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.49 ' HG ' ' HZ1' ' A' ' 17' ' ' LYS . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.58 109.723 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.448 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.848 0.356 . . . . 5.65 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.91 53.45 2.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 4.09 110.691 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 69.5 p -122.65 80.52 1.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 2.29 110.944 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -121.33 9.76 10.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 2.27 111.129 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.562 ' HE2' ' HB3' ' A' ' 68' ' ' ALA . 0.3 OUTLIER 57.49 85.16 0.09 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.15 -0.477 . . . . 1.22 111.34 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.533 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 -80.25 106.55 5.28 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.689 -0.232 . . . . 1.72 110.449 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HD2' ' HZ2' ' A' ' 8' ' ' LYS . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.76 112.88 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HZ2' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 2.0 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 1.17 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.564 ' O ' HG22 ' A' ' 72' ' ' VAL . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 1.19 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.615 HG23 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.83 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.514 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.496 ' HZ2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.93 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.17 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.41 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HZ3' ' HB3' ' A' ' 84' ' ' SER . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 1.55 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.81 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.507 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 1.04 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.17 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.591 ' HE3' ' HG2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 1.14 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.604 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.13 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.17 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.739 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.78 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 1.51 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.443 ' HB3' HD13 ' A' ' 28' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 1.0 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.456 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.98 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.558 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 1.51 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.739 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.45 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.558 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 1.43 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.629 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.93 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.517 ' HA ' HD13 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.76 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.18 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.637 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 1.07 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 1.51 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.681 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.86 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.12 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.25 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.615 HG13 ' HZ1' ' A' ' 76' ' ' LYS . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.85 111.31 -179.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.637 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.14 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.635 HG21 HG11 ' A' ' 72' ' ' VAL . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.3 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.425 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.91 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.581 HD21 HG22 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.4 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.412 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.581 HG22 HD21 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.92 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 1.51 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.532 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.63 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.681 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.75 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.629 ' HB3' ' HH ' ' A' ' 31' ' ' TYR . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.54 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.464 HD13 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.38 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.27 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.618 ' HA ' HD12 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 1.05 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.552 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 3.06 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 3.03 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.34 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.19 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.583 ' HZ1' HD13 ' A' ' 71' ' ' ILE . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.78 109.024 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.562 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.444 ' HE1' HD13 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.17 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.16 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.583 HD13 ' HZ1' ' A' ' 67' ' ' LYS . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.28 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.635 HG11 HG21 ' A' ' 44' ' ' ILE . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.17 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.425 HG12 ' HE1' ' A' ' 45' ' ' TYR . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.29 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.615 ' HB2' HG23 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.93 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.615 ' HZ1' HG13 ' A' ' 41' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 2.2 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 3.05 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.404 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.529 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.25 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.441 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.458 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.85 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.568 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.58 109.84 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.429 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.3 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.758 0.313 . . . . 5.65 110.862 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -100.58 119.68 38.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 4.09 110.905 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.459 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 14.1 p -89.3 14.15 11.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 2.29 110.601 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 m -62.4 145.15 54.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 2.27 110.629 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.487 ' HG3' ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -86.14 81.8 8.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.077 -0.511 . . . . 1.22 111.199 -179.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.539 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 -65.21 105.75 0.84 Allowed Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 116.464 -0.335 . . . . 1.72 110.836 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.479 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.76 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.559 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 2.0 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 1.17 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 1.19 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.488 HG22 ' CD2' ' A' ' 75' ' ' TYR . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.83 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.439 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.6 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.93 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.17 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.468 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.41 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HZ1' ' HB3' ' A' ' 84' ' ' SER . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 1.55 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.439 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.81 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 1.04 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.613 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.17 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.6 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 1.14 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.13 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.17 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.78 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 1.51 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.98 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.565 ' HA ' ' HG2' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 1.51 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.45 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 1.43 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.457 ' CD2' HG11 ' A' ' 56' ' ' VAL . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.93 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.515 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.76 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.18 112.467 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.563 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 1.07 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.613 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 1.51 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.591 ' HG1' ' HZ2' ' A' ' 54' ' ' LYS . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.86 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.486 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.12 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.638 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.25 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.425 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.85 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.553 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.14 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.3 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.459 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.91 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.637 HD21 HG22 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.4 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.485 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.637 HG22 HD21 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.92 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.646 HD12 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 1.51 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.63 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.591 ' HZ2' ' HG1' ' A' ' 38' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.75 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.569 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.54 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.468 HD11 HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.38 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.27 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.646 ' HA ' HD12 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 1.05 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.559 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 3.06 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 3.03 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.34 110.661 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.19 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.491 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.78 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.487 ' HB3' ' HG3' ' A' ' 5' ' ' MET . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.17 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.16 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.28 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.541 HG11 HG21 ' A' ' 44' ' ' ILE . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.17 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.489 HG12 HD13 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.29 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.493 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.93 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 2.2 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 3.05 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.493 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.25 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.85 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.546 ' HB3' ' HZ1' ' A' ' 17' ' ' LYS . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.58 109.975 179.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.424 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.874 0.369 . . . . 5.65 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -103.2 99.31 9.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 4.09 110.763 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.47 ' HB3' ' NE ' ' A' ' 27' ' ' ARG . 93.2 p -94.66 27.48 3.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.283 -0.417 . . . . 2.29 111.314 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -60.81 122.47 14.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.696 0.284 . . . . 2.27 110.676 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.51 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -71.79 78.68 0.86 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 1.22 111.008 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.5 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -66.73 107.68 1.83 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.222 -0.444 . . . . 1.72 110.713 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HD2' ' HZ1' ' A' ' 8' ' ' LYS . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.76 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HZ1' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 2.0 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.468 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 1.17 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.616 ' O ' HG22 ' A' ' 72' ' ' VAL . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 1.19 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.478 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.83 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.478 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.93 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.651 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.17 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.41 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HZ3' ' HB3' ' A' ' 84' ' ' SER . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 1.55 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.81 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.56 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 1.04 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.17 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.478 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 1.14 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.13 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.17 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.78 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 1.51 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 1.0 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.505 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.98 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.517 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 1.51 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.45 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 1.43 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.467 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.93 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 36' ' ' SER . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.76 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.18 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.623 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 1.07 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 1.51 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.56 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.86 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.12 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.599 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.25 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.719 HD12 ' HZ3' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.85 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB2' HG21 ' A' ' 38' ' ' THR . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.623 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.14 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.688 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.3 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.434 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.91 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.577 HD22 HG22 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.4 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.577 HG22 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.92 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.616 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 1.51 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.523 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.63 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.75 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.616 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.416 HD13 ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.54 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' NH2' ' A' ' 62' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.38 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.602 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.597 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.27 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.557 ' HA ' HD12 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 1.05 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 3.06 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 3.03 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.409 ' HG ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.34 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.19 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' HB2' ' HE3' ' A' ' 5' ' ' MET . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.78 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.403 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.17 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.16 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.28 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.688 HG11 HG21 ' A' ' 44' ' ' ILE . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.17 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.507 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.29 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.496 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.93 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.719 ' HZ3' HD12 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 2.2 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 3.05 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.567 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.25 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.447 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.85 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.497 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.58 110.054 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.451 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.835 0.35 . . . . 5.65 110.825 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.44 HD21 ' H ' ' A' ' 5' ' ' MET . 3.9 p-10 -121.69 172.45 8.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 4.09 110.996 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.516 ' HG ' ' HD3' ' A' ' 64' ' ' LYS . 73.5 m -94.43 48.46 1.23 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 2.29 111.054 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.7 m 55.91 56.49 5.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.081 -0.509 . . . . 2.27 111.513 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.482 ' HG2' ' HE3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -73.33 98.04 2.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.399 -0.364 . . . . 1.22 110.241 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.458 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -96.88 103.05 13.42 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 1.72 111.148 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HZ2' ' A' ' 8' ' ' LYS . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.76 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.565 ' HZ2' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 2.0 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 1.17 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HG22 ' A' ' 72' ' ' VAL . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 1.19 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.593 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.83 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.498 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.447 ' HE2' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.93 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.17 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 13' ' ' PRO . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.41 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.583 ' HZ2' ' HG ' ' A' ' 84' ' ' SER . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 1.55 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.81 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 1.04 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.17 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 1.14 109.568 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.647 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.13 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.17 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.78 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 1.51 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.416 HD21 HD22 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 1.0 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.98 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.572 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 1.51 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.45 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HE3' HD22 ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 1.43 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.452 ' CD2' HG11 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.93 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.453 ' HA ' HD13 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.76 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.18 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 56' ' ' VAL . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 1.07 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 1.51 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.613 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.86 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.12 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.643 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.25 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.85 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB2' HG21 ' A' ' 38' ' ' THR . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.518 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.14 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.3 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.456 ' HE1' ' HZ2' ' A' ' 76' ' ' LYS . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.91 111.215 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.515 HD22 HG22 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.4 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.472 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.482 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.92 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.742 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 1.51 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.472 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.448 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.63 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.75 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.742 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.54 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.52 HD11 HH21 ' A' ' 62' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.38 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.27 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.52 HH21 HD11 ' A' ' 59' ' ' LEU . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 1.05 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 3.06 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.516 ' HD3' ' HG ' ' A' ' 3' ' ' SER . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 3.03 111.293 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.34 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.19 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.78 108.929 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.402 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.447 ' O ' ' HB ' ' A' ' 44' ' ' ILE . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.17 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.16 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.28 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.61 HG22 ' O ' ' A' ' 10' ' ' LEU . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.17 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.29 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.44 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.93 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.482 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 2.2 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 3.05 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.42 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.593 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.25 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.429 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.85 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.583 ' HG ' ' HZ2' ' A' ' 17' ' ' LYS . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.58 110.378 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.498 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.444 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.2 m . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.791 0.329 . . . . 5.65 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.77 -169.2 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 4.09 110.919 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.546 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 4.1 p 56.26 27.69 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.139 -0.482 . . . . 2.29 110.59 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.3 m -85.3 16.22 3.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.945 -0.57 . . . . 2.27 111.451 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 58.61 78.01 0.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.325 -0.398 . . . . 1.22 110.92 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.488 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 -75.79 109.69 8.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.225 -0.443 . . . . 1.72 111.465 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HD2' ' HZ3' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.76 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HZ3' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 2.0 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.421 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 1.17 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.571 ' O ' HG22 ' A' ' 72' ' ' VAL . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 1.19 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.475 HG22 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.83 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.93 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.17 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.41 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 1.55 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.81 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 1.04 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.17 111.323 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.437 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 1.14 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.701 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.13 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.515 HD13 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.17 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.78 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 1.51 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.508 HD21 HD22 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.546 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.98 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.514 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 1.51 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.438 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.45 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 1.43 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.431 ' CD2' HG11 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.93 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.515 ' HA ' HD13 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.76 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.45 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.18 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 1.07 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 1.51 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.86 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.12 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.606 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.25 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.6 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.85 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.463 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.65 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.14 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.672 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.3 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.91 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.646 HD21 HG22 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.4 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.505 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.646 HG22 HD21 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.92 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 1.51 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.486 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.63 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.51 ' HG3' HD13 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.75 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.608 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.543 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.54 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.505 HD11 HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.38 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.27 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 1.05 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.575 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 3.06 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 3.03 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.34 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.19 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.478 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.78 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.427 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.17 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.16 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.28 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.672 HG11 HG21 ' A' ' 44' ' ' ILE . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.17 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.505 HG12 HD13 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.29 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.93 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.6 ' HZ1' HD13 ' A' ' 41' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 2.2 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 3.05 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.519 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.25 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.449 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.45 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.85 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.58 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.405 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.766 0.317 . . . . 5.65 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -119.61 28.54 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 4.09 110.662 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -88.76 41.7 1.04 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 2.29 110.717 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 t -80.18 141.87 35.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.084 -0.507 . . . . 2.27 111.242 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.515 ' HG3' ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -84.19 82.36 8.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 1.22 110.783 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.495 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -70.26 109.11 4.27 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.357 -0.383 . . . . 1.72 111.461 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' O ' HG23 ' A' ' 11' ' ' THR . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.76 112.396 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 2.0 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 1.17 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 72' ' ' VAL . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 1.19 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.517 ' HB ' HG12 ' A' ' 81' ' ' ILE . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.83 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.93 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.608 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.17 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 12' ' ' ASP . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.41 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 1.55 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.453 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.81 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 1.04 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.17 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.538 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 1.14 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.608 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.13 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.17 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.78 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 1.51 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.505 HD11 HD22 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 1.0 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.98 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.538 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 1.51 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.457 ' H ' ' HD1' ' A' ' 29' ' ' HIS . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.45 107.112 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.478 ' HE3' HD22 ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 1.43 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE2' ' HD2' ' A' ' 30' ' ' LYS . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.93 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.45 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.76 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.18 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.488 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 1.07 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 1.51 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.569 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.86 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.508 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.12 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.616 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.25 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.502 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.85 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HB2' HG21 ' A' ' 38' ' ' THR . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.582 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.14 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.3 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.451 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.91 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.712 HD12 ' NZ ' ' A' ' 54' ' ' LYS . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.4 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.466 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.92 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.689 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 1.51 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.5 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.63 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.712 ' NZ ' HD12 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.75 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.689 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.455 HD13 ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.62 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.54 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.497 HD23 ' NH2' ' A' ' 62' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.38 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.62 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.27 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.603 ' HA ' HD12 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 1.05 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 3.06 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 3.03 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.436 ' HG ' HD12 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.34 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.19 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.78 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.515 ' HB3' ' HG3' ' A' ' 5' ' ' MET . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.17 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.28 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 10' ' ' LEU . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.17 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.508 HG12 HD13 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.29 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.454 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.93 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.586 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 2.2 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 3.05 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.25 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.432 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.503 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.85 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.58 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.849 0.357 . . . . 5.65 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -82.14 175.71 10.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 4.09 110.789 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.1 m -78.1 1.42 21.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 2.29 110.292 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 p 75.17 -49.15 0.64 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.411 -0.813 . . . . 2.27 111.94 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.536 ' HB3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER 65.98 -75.09 0.05 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.634 0.254 . . . . 1.22 110.747 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.419 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER 72.04 91.04 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 178.237 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.709 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.76 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.709 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 2.0 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.472 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 1.17 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.56 HD23 HD23 ' A' ' 26' ' ' LEU . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 1.19 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.83 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.459 ' CB ' ' HB3' ' A' ' 85' ' ' ALA . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.432 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.93 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.687 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.17 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.473 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.41 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HZ2' ' HG ' ' A' ' 84' ' ' SER . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 1.55 110.078 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.478 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.81 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.595 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 1.04 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.433 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.17 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.478 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 1.14 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.687 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.13 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.533 HD22 HD13 ' A' ' 26' ' ' LEU . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.17 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.78 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 1.51 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.572 ' HB2' HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 1.0 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.477 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.98 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 1.51 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.45 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.541 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 1.43 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.561 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.93 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.523 ' HA ' HD13 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.76 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.18 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.564 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 1.07 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.433 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 1.51 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.595 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.86 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.12 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.645 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.25 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.484 HG13 ' HZ1' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.85 111.005 -179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HB2' HG21 ' A' ' 38' ' ' THR . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.577 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.14 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.645 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.3 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.416 ' H ' ' C ' ' A' ' 43' ' ' LEU . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.91 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.577 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.4 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.92 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 1.51 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.56 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.63 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.75 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.653 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.54 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.38 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 64' ' ' LYS . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.611 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.27 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.56 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 1.05 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.583 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 3.06 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.441 ' O ' ' HE3' ' A' ' 5' ' ' MET . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 3.03 111.455 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.554 HD11 HD21 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.34 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.19 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.469 ' HB2' ' CE ' ' A' ' 5' ' ' MET . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.78 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.497 ' H ' ' HE3' ' A' ' 5' ' ' MET . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.505 ' HA ' ' HA ' ' A' ' 44' ' ' ILE . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.17 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.16 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.28 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.617 HG11 HG21 ' A' ' 44' ' ' ILE . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.17 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.432 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.29 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.531 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.93 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.599 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 2.2 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 3.05 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.531 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.599 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.25 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.423 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.85 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.566 ' HG ' ' HZ2' ' A' ' 17' ' ' LYS . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.58 109.857 179.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.459 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.536 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.642 ' H1 ' ' HE ' ' A' ' 27' ' ' ARG . 79.1 p . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.653 0.263 . . . . 5.65 110.907 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 60.54 63.63 1.32 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.144 -0.48 . . . . 4.09 111.012 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -92.67 7.33 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 2.29 110.216 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.8 t -63.41 154.21 32.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.709 -0.678 . . . . 2.27 111.308 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.573 ' HE2' ' HB3' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -77.85 103.72 7.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 1.22 110.479 179.527 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -90.97 109.54 35.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.617 -0.265 . . . . 1.72 111.133 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 5' ' ' MET . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.76 113.257 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 2.0 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.512 ' HG ' ' HG ' ' A' ' 25' ' ' SER . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 1.17 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.605 ' O ' HG22 ' A' ' 72' ' ' VAL . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 1.19 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.525 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.83 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.488 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.462 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.93 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.17 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.529 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.41 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 1.55 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.81 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 35' ' ' LEU . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 1.04 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.446 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.17 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 1.14 109.52 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.13 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.467 HD11 ' HB2' ' A' ' 35' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.17 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.78 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.512 ' HG ' ' HG ' ' A' ' 9' ' ' SER . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 1.51 110.273 179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.5 ' HB3' HD13 ' A' ' 28' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 1.0 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.642 ' HE ' ' H1 ' ' A' ' 1' ' ' SER . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.98 111.002 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 26' ' ' LEU . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 1.51 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.45 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 1.43 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.434 ' CD2' HG11 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.93 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.76 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.18 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 1.07 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 1.51 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.447 HG21 ' HB2' ' A' ' 42' ' ' GLU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.86 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.45 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.12 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.25 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.488 HD13 ' HZ1' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.85 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HB2' HG21 ' A' ' 38' ' ' THR . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.14 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.3 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.522 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.91 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.4 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.426 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.537 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.603 HG22 HD21 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.92 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.648 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 1.51 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.63 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.582 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.75 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.648 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.431 ' HB2' ' CB ' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.54 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.549 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.38 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' ' CD2' ' A' ' 28' ' ' LEU . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.27 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 1.05 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 3.06 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 3.03 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.34 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.19 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.78 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.573 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.457 ' HE1' HD13 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.17 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.16 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.28 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.605 HG22 ' O ' ' A' ' 10' ' ' LEU . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.17 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG12 HD13 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.29 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.464 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.687 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.93 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.58 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 2.2 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 3.05 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.553 HD12 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.25 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.438 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.432 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.85 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.58 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.486 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.432 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.701 0.286 . . . . 5.65 110.857 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 56.57 -158.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.263 -0.426 . . . . 4.09 110.967 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 35.7 p 48.64 54.39 10.69 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.276 -0.42 . . . . 2.29 110.972 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 m -113.0 12.53 19.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.957 -0.565 . . . . 2.27 110.987 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.42 ' HA ' HD13 ' A' ' 10' ' ' LEU . 0.5 OUTLIER 58.04 59.71 3.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.979 -0.555 . . . . 1.22 111.265 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.575 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 16.0 m120 -55.52 105.64 0.56 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 1.72 111.347 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.487 ' O ' HG23 ' A' ' 11' ' ' THR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.76 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.61 ' HB3' ' HZ1' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 2.0 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.427 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 1.17 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.549 ' O ' HG22 ' A' ' 72' ' ' VAL . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 1.19 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.527 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.83 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.403 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.93 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.677 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.17 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.516 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.41 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 1.55 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.558 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.81 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 1.04 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.473 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.17 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.558 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 1.14 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.677 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.13 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.533 HD13 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.17 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.78 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 1.51 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.489 HD11 HD22 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 1.0 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.98 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 30' ' ' LYS . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 1.51 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.45 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 1.43 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.421 ' CD2' HG11 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.93 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.533 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.76 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.422 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.18 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 1.07 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 1.51 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.86 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.12 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.583 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.25 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.695 HD12 ' HZ1' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.85 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HB2' HG21 ' A' ' 38' ' ' THR . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.14 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.678 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.3 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.441 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.91 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.4 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.513 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.481 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.883 HG21 ' HD3' ' A' ' 54' ' ' LYS . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.92 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.692 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 1.51 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.63 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.883 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.75 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD12 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.509 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.698 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.54 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.534 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.38 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.698 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.27 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.542 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 1.05 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 3.06 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 3.03 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.34 110.579 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.19 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.78 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.446 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.424 ' HE1' HD13 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.17 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.16 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.28 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.17 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.484 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.29 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.93 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.695 ' HZ1' HD12 ' A' ' 41' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 2.2 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 3.05 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.508 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.527 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.448 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.85 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.58 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.445 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.845 0.355 . . . . 5.65 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -147.31 107.34 4.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 4.09 110.907 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.9 p -73.21 87.53 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 2.29 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.8 p -101.6 151.28 22.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.026 -0.533 . . . . 2.27 110.867 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.632 ' HB3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.01 -63.33 1.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.252 -0.431 . . . . 1.22 111.055 -179.914 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.44 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 72.04 83.32 0.15 Allowed Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.928 -0.578 . . . . 1.72 111.831 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.679 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.76 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.679 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 2.0 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 1.17 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.632 HD12 ' HB3' ' A' ' 5' ' ' MET . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 1.19 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.552 HG23 ' O ' ' A' ' 7' ' ' PRO . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.83 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.463 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.611 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.93 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.17 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.41 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.426 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 1.55 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.81 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 1.04 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.422 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.17 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.611 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 1.14 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.63 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.13 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.541 HD13 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.17 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.78 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 1.51 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.501 HD21 HD22 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.98 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.567 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 1.51 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.45 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 1.43 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.473 ' CD2' HG11 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.93 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.541 ' HA ' HD13 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.76 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.18 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 1.07 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.51 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.86 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.12 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.671 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.25 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.85 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HB2' HG21 ' A' ' 38' ' ' THR . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.14 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.671 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.3 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.414 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.91 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.549 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.4 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.476 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.52 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.87 HG21 ' HD3' ' A' ' 54' ' ' LYS . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.92 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.691 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 1.51 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.591 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.63 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.75 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.691 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.54 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.462 HD11 HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.38 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.27 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.591 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 1.05 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.573 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 3.06 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 3.03 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.535 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.34 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.19 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.628 ' HB3' ' HE3' ' A' ' 5' ' ' MET . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.78 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' HG21 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.499 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.17 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.16 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.28 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 44' ' ' ILE . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.17 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.735 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.29 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.503 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.93 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.735 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 2.2 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 3.05 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.503 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.543 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.25 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.46 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.453 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.85 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.58 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.463 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.926 0.393 . . . . 5.65 110.922 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -142.37 65.99 1.34 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.175 -0.466 . . . . 4.09 110.842 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -88.3 79.37 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 2.29 110.648 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -89.59 141.64 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 2.27 111.277 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.531 ' HG3' ' HB3' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -93.27 83.76 4.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 1.22 110.575 179.763 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.538 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 -69.3 107.38 2.11 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.317 -0.401 . . . . 1.72 111.322 -179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.76 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 2.0 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.466 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 1.17 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.557 ' O ' HG22 ' A' ' 72' ' ' VAL . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 1.19 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.521 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.83 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.526 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.495 ' HZ2' ' HG3' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.93 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.618 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.17 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.41 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.526 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 1.55 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.532 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.81 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 1.04 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.411 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.17 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.574 ' HE3' ' HG3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 1.14 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.618 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.13 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.17 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HG3' ' HE3' ' A' ' 21' ' ' MET . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.78 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 1.51 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.503 HD21 HD22 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 1.0 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.98 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.685 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 1.51 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.478 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.45 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.685 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 1.43 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.42 ' CE1' ' HA ' ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.93 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.478 ' OG ' ' HA ' ' A' ' 29' ' ' HIS . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.76 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.437 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.18 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 1.07 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 1.51 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.86 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.12 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.684 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.25 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.526 HD13 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.85 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.45 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.653 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.14 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.684 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.3 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.91 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.609 HD21 HG22 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.4 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.576 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.572 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.869 HG21 ' HD3' ' A' ' 54' ' ' LYS . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.92 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.67 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 1.51 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.587 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.453 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.63 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.869 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.75 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.67 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.528 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.54 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.479 HD23 HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.38 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.509 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.531 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.27 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.587 HH11 ' HB2' ' A' ' 52' ' ' GLU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 1.05 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 3.06 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 3.03 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.446 HD21 HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.34 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.19 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.484 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.78 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.531 ' HB3' ' HG3' ' A' ' 5' ' ' MET . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.479 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.17 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.16 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.28 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.604 HG11 HG21 ' A' ' 44' ' ' ILE . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.17 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.767 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.29 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.512 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.93 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.767 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 2.2 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 3.05 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.512 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.25 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.458 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.432 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.85 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.58 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.473 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.453 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.596 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 43.0 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.755 0.312 . . . . 5.65 110.941 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -170.34 136.61 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 4.09 111.071 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.0 p -90.3 110.84 21.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 2.29 110.681 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.4 m -107.76 1.35 22.88 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.421 -0.354 . . . . 2.27 111.534 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.56 59.85 2.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 1.22 111.257 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.535 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -58.14 108.35 1.26 Allowed Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.342 -0.39 . . . . 1.72 110.976 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.725 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.76 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 2.0 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 1.17 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.557 ' O ' HG22 ' A' ' 72' ' ' VAL . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 1.19 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.475 HG23 ' O ' ' A' ' 7' ' ' PRO . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.83 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.565 ' HZ2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.93 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.17 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.41 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.409 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 1.55 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.81 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 1.04 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.439 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.17 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.565 ' HG2' ' HZ2' ' A' ' 14' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 1.14 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.13 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.17 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.78 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 1.51 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.487 HD21 HD12 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 1.0 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.596 ' HE ' ' HA ' ' A' ' 1' ' ' SER . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.98 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.554 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 1.51 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.457 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.45 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 1.43 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.93 110.88 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' HD13 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.76 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.18 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 1.07 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 1.51 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.558 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.86 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.494 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.12 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.642 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.25 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.421 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.85 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.14 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.3 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.91 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.4 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.468 ' HA ' HD21 ' A' ' 66' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.567 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.519 HG22 HD21 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.92 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.609 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 1.51 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.526 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.63 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.75 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.609 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.54 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.462 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.38 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.656 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.27 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.567 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 1.05 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.562 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 3.06 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 3.03 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.34 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.19 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.544 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.78 108.961 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.17 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.16 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.28 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.581 HG11 HG21 ' A' ' 44' ' ' ILE . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.17 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.52 HG12 HD13 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.29 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.44 ' CD2' HG22 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.93 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 2.2 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 3.05 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.558 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.25 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.412 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.59 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.85 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.58 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.505 ' HH ' ' HG2' ' A' ' 76' ' ' LYS . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.805 0.336 . . . . 5.65 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.2 t30 55.03 85.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 4.09 111.068 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.5 t -55.33 -66.37 0.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.112 -0.495 . . . . 2.29 110.793 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.8 t 53.75 93.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 2.27 111.14 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.573 ' HE2' ' HB3' ' A' ' 68' ' ' ALA . 0.4 OUTLIER -50.4 98.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 1.22 111.086 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.442 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 -80.3 107.31 6.74 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.421 . . . . 1.72 110.778 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 5' ' ' MET . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.76 112.423 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.528 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 2.0 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.446 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 1.17 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.577 ' O ' HG22 ' A' ' 72' ' ' VAL . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 1.19 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.83 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HG3' ' HB3' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.688 ' HZ1' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.93 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.17 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.41 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 84' ' ' SER . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 1.55 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.81 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 1.04 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.421 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.17 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.688 ' HG2' ' HZ1' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 1.14 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.595 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.13 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.17 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.78 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 1.51 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 1.0 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.98 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.621 HD21 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 1.51 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.45 107.201 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.621 ' HE3' HD21 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 1.43 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.566 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.93 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 36' ' ' SER . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.76 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.444 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.18 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 1.07 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 1.51 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.618 ' HG1' ' HZ3' ' A' ' 54' ' ' LYS . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.86 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.506 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.12 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.638 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.25 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.85 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 38' ' ' THR . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.14 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.3 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.447 ' HE1' ' HZ1' ' A' ' 76' ' ' LYS . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.91 111.37 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.51 HD21 HG22 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.4 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.498 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.527 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.92 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.665 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 1.51 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.567 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.471 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.63 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.618 ' HZ3' ' HG1' ' A' ' 38' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.75 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.665 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.54 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.38 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.27 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 1.05 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.537 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 3.06 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.486 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 3.03 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.34 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.19 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.78 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.573 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.17 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.16 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.28 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.579 HG11 HG21 ' A' ' 44' ' ' ILE . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.17 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.514 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.29 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.495 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 2.2 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.428 ' O ' HD13 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 3.05 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 78' ' ' ARG . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.25 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.442 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.85 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.601 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.58 110.129 179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.452 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.488 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.836 0.351 . . . . 5.65 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -100.42 -178.05 3.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 4.09 110.843 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.666 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 31.4 p -162.09 32.82 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.49 . . . . 2.29 110.797 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.3 m -90.02 13.72 14.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 2.27 110.555 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.518 ' HG3' ' HB3' ' A' ' 68' ' ' ALA . 0.6 OUTLIER 60.08 72.99 0.5 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.61 -0.723 . . . . 1.22 111.412 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.484 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 -70.06 108.71 3.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 1.72 110.464 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.745 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.76 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.745 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 2.0 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.43 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 1.17 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.54 ' O ' HG22 ' A' ' 72' ' ' VAL . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 1.19 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 7' ' ' PRO . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.83 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.65 ' HZ3' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.93 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.17 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.41 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.517 ' HZ2' ' HB3' ' A' ' 84' ' ' SER . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 1.55 110.147 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.81 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 1.04 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.17 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.65 ' HG2' ' HZ3' ' A' ' 14' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 1.14 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.624 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.13 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.537 HD13 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.17 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.78 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 1.51 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.69 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 1.0 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.98 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.567 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 1.51 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.601 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.45 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 1.43 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.489 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.93 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.537 ' HA ' HD13 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.76 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.405 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.18 112.488 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.596 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 1.07 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 1.51 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.86 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.12 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.636 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.25 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.453 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.85 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HB2' HG21 ' A' ' 38' ' ' THR . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.596 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.14 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.3 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.481 ' HH ' ' HE3' ' A' ' 76' ' ' LYS . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.91 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.625 HD22 HG22 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.4 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.421 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.513 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.884 HG21 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.92 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.652 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 1.51 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.496 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.63 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.884 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.75 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.652 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.455 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.549 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.54 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.511 HD11 HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.38 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.27 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.571 ' HA ' HD12 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 1.05 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 3.06 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 3.03 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.34 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.19 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.468 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.78 108.813 179.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.518 ' HB3' ' HG3' ' A' ' 5' ' ' MET . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.17 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.16 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.28 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.622 HG11 HG21 ' A' ' 44' ' ' ILE . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.17 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.52 HG12 HD13 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.29 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.43 ' CD2' HG22 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.93 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.493 ' HB2' HD12 ' A' ' 81' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 2.2 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 3.05 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.493 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.25 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.446 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.438 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.85 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.517 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.58 109.742 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.438 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.91 0.386 . . . . 5.65 110.864 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 4' ' ' SER . 3.0 p-10 -111.62 171.23 7.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 4.09 110.827 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -59.84 -49.97 75.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 2.29 110.48 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.405 ' N ' HD21 ' A' ' 2' ' ' ASN . 3.2 p -178.59 -70.31 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.024 -0.535 . . . . 2.27 111.102 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.67 ' HG2' ' HE3' ' A' ' 67' ' ' LYS . 0.4 OUTLIER 57.58 93.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.414 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.458 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.2 m120 -109.14 103.82 53.4 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.972 -0.558 . . . . 1.72 110.887 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' O ' HG23 ' A' ' 11' ' ' THR . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.76 111.885 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 2.0 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 1.17 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 72' ' ' VAL . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 1.19 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.519 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.83 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.534 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.449 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.93 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.637 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.17 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 40' ' ' TRP . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.41 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 1.55 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.81 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.457 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 1.04 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.17 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 1.14 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.637 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.13 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.5 HD13 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.17 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.78 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 1.51 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.444 HD11 HD22 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 1.0 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.98 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD22 ' HB1' ' A' ' 61' ' ' ALA . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 1.51 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.519 ' HE3' HD22 ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 1.43 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.461 ' O ' HD11 ' A' ' 35' ' ' LEU . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.93 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' HD13 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.76 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.431 ' HB1' ' C ' ' A' ' 54' ' ' LYS . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.18 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.624 HD11 ' N ' ' A' ' 35' ' ' LEU . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 1.07 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.481 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 1.51 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.422 HG21 ' HB2' ' A' ' 42' ' ' GLU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.86 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.12 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.25 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.85 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB2' HG21 ' A' ' 38' ' ' THR . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.501 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.14 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.7 HD12 ' HZ2' ' A' ' 76' ' ' LYS . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.3 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.496 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.91 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.594 HD21 HG22 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.4 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.497 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.494 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.886 HG21 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.92 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.599 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 1.51 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.63 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.886 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.75 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.633 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.54 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.514 HD11 HH21 ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.38 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.633 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.27 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.568 ' HA ' HD12 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 1.05 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 3.06 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.565 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 3.03 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 HD13 HD23 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.34 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.19 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.67 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.78 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.562 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.17 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.16 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.553 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.28 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.626 HG11 HG21 ' A' ' 44' ' ' ILE . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.17 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.7 ' HA ' ' HZ3' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.29 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.453 ' CD2' HG22 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.93 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.7 ' HZ2' HD12 ' A' ' 44' ' ' ILE . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 2.2 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 3.05 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.556 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.25 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.45 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.85 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.58 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.531 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.459 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.786 0.326 . . . . 5.65 110.98 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.402 HD22 ' HE ' ' A' ' 27' ' ' ARG . 3.6 p-10 -141.01 -176.96 4.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 4.09 110.886 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.45 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 77.4 p -150.42 72.49 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 2.29 110.703 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -85.72 131.8 34.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 2.27 110.981 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.528 ' O ' ' HD3' ' A' ' 7' ' ' PRO . 0.5 OUTLIER -83.85 107.53 16.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.066 -0.515 . . . . 1.22 110.797 179.657 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.452 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 -89.88 103.19 5.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 1.72 111.058 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 5' ' ' MET . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.76 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 2.0 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.548 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 1.17 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.51 ' HB3' HG22 ' A' ' 72' ' ' VAL . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 1.19 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 7' ' ' PRO . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.83 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.441 ' HA ' HD13 ' A' ' 16' ' ' LEU . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.542 ' HZ3' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.93 109.312 179.354 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.669 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.17 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.41 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 1.55 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.81 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.603 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 1.04 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.479 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.17 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.542 ' HG2' ' HZ3' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 1.14 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.669 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.13 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.17 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.483 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.78 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 1.51 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.547 ' C ' ' HD2' ' A' ' 27' ' ' ARG . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 1.0 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.547 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.98 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.535 HD22 ' HB1' ' A' ' 61' ' ' ALA . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 1.51 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.45 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 1.43 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.462 ' HH ' ' HB3' ' A' ' 58' ' ' ALA . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.93 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.487 ' HA ' HD13 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.76 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB1' ' N ' ' A' ' 55' ' ' GLY . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.18 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.631 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 1.07 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.479 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 1.51 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.603 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.86 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.12 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.615 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.25 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.487 HD13 ' HZ2' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.85 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 38' ' ' THR . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.631 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.14 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.3 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.451 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.91 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.56 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.4 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.495 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.496 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.893 HG21 ' HD3' ' A' ' 54' ' ' LYS . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.92 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.605 HD12 ' HA ' ' A' ' 62' ' ' ARG . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 1.51 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.524 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.63 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG21 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.75 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.416 ' N ' ' HB1' ' A' ' 34' ' ' ALA . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.416 ' HA ' ' CD1' ' A' ' 31' ' ' TYR . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.54 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.448 HD11 HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.38 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HB1' HD22 ' A' ' 28' ' ' LEU . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.27 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HA ' HD12 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 1.05 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.563 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 3.06 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 3.03 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.475 ' HB2' HD12 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.34 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.19 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.78 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.536 ' HB3' HD23 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.17 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.16 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.28 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.583 HG11 HG21 ' A' ' 44' ' ' ILE . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.17 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.483 HG12 HD13 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.29 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.513 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.93 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.603 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 2.2 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 3.05 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.513 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.603 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.25 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.436 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.85 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.58 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.42 ' HB3' ' CB ' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.478 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.796 0.331 . . . . 5.65 110.938 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.431 ' H ' ' HG2' ' A' ' 27' ' ' ARG . 66.1 t30 -135.24 23.99 3.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 4.09 110.864 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.46 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 71.7 p -86.52 74.72 9.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 2.29 110.752 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.2 m -85.69 1.91 47.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 2.27 111.186 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.569 ' HG2' ' HE2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER 56.74 61.84 2.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.999 -0.546 . . . . 1.22 110.913 -179.709 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 -57.43 107.44 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 1.72 111.286 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.697 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.76 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.697 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 2.0 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.513 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 1.17 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.597 HD22 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 1.19 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.514 HG23 ' O ' ' A' ' 7' ' ' PRO . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.83 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.521 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.419 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.93 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.695 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.17 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.41 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 1.55 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.449 ' HB3' ' HB2' ' A' ' 21' ' ' MET . 0.8 OUTLIER -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.81 109.225 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.544 HD11 ' HA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 1.04 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.17 110.983 178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.522 ' HB3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 1.14 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.695 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.13 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.465 ' CD1' ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.17 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.78 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 1.51 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.597 HD21 HD22 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.483 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.98 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.51 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 1.51 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.491 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.45 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HE2' ' O ' ' A' ' 27' ' ' ARG . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 1.43 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.458 ' CD2' HG11 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.93 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.491 ' OG ' ' HA ' ' A' ' 29' ' ' HIS . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.76 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.481 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.18 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 1.07 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 1.51 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.53 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.86 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.12 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.637 ' HZ3' ' NZ ' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.25 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.85 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' HG21 ' A' ' 38' ' ' THR . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.14 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.666 HD12 ' HZ3' ' A' ' 76' ' ' LYS . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.3 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.91 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HG ' ' HA ' ' A' ' 43' ' ' LEU . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.4 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.501 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.573 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.597 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.92 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.628 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 1.51 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.63 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.75 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.628 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.421 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.54 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.38 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.625 ' HB3' ' HB2' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.27 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.573 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 1.05 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.544 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 3.06 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 3.03 110.713 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.34 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.533 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.19 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.569 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.78 108.746 179.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.491 ' HB3' ' HE2' ' A' ' 5' ' ' MET . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.488 ' HB3' ' O ' ' A' ' 44' ' ' ILE . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.17 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.16 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.28 110.951 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.508 HG11 HG21 ' A' ' 44' ' ' ILE . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.17 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.677 ' HA ' ' HZ1' ' A' ' 76' ' ' LYS . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.29 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.93 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.677 ' HZ1' ' HA ' ' A' ' 73' ' ' ILE . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 2.2 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 3.05 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.538 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.599 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.25 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.85 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.58 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.52 ' HB3' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.404 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 110.739 -0.097 . . . . 1.72 110.739 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.43 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.575 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 1.39 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 0.71 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 0.5 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.476 ' HB ' HG12 ' A' ' 81' ' ' ILE . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.35 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.545 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.532 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.37 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.668 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.12 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.27 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 0.88 110.03 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.53 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 0.49 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.401 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.15 110.34 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.598 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 0.94 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.668 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.11 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.13 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.757 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.29 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 0.96 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.66 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.34 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' ' 65' ' ' LEU . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.67 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.757 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.29 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 0.72 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CG ' HG22 ' A' ' 56' ' ' VAL . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.28 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.15 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 0.47 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 0.95 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.618 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.11 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.09 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.21 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.45 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.578 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.11 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.2 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.19 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 50' ' ' THR . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.14 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.573 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.687 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.852 HG21 HD22 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.19 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.663 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 0.89 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.629 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.19 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.2 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.417 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.417 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.21 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.461 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.27 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.16 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.65 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 0.81 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 2.47 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 2.52 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.23 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.15 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.2 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.686 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.501 ' HE1' HD12 ' A' ' 43' ' ' LEU . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.12 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.13 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.25 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 68' ' ' ALA . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.15 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.52 ' CG1' HD12 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.28 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.567 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.41 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.641 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 2.37 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.567 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.641 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.18 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.48 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.09 110.035 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.682 -0.118 . . . . 1.72 110.682 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.74 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.43 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 1.39 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.45 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 0.71 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 26' ' ' LEU . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.5 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.542 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.35 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.37 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.12 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 10' ' ' LEU . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.27 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.58 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 0.88 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.53 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 0.49 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.15 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.44 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 0.94 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.11 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.13 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.29 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 0.96 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.34 111.819 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 0.67 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.29 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HE3' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 0.72 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.582 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.28 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.697 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.3 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.424 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.15 112.544 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 56' ' ' VAL . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 0.47 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 32' ' ' SER . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 0.95 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.575 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.11 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.09 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.703 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.21 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.456 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.45 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.11 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.19 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.14 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.578 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.87 HG22 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.19 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 0.89 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.19 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.2 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.21 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.27 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.16 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 0.81 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 66' ' ' LEU . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 2.47 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 2.52 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.23 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.15 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.2 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.531 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.12 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.13 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.25 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.15 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.76 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.28 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.54 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.41 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 1.66 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 2.37 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.54 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.18 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.48 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.09 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.491 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.632 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 48.5 m-80 . . . . . 0 CA--C 1.528 0.131 0 N-CA-C 111.538 0.199 . . . . 1.72 111.538 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.43 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.632 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 1.39 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 0.71 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 26' ' ' LEU . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 0.5 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.571 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.35 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.37 109.576 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.12 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.744 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.27 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 0.88 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.438 ' OD1' ' HB2' ' A' ' 21' ' ' MET . 3.5 t-20 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 0.49 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.15 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.438 ' HB2' ' OD1' ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 0.94 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.69 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.11 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.13 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.29 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 0.96 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 0.66 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.34 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 65' ' ' LEU . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 0.67 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.29 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 0.72 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.41 ' CG ' HG22 ' A' ' 56' ' ' VAL . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.28 110.369 179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.627 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.3 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.15 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 0.47 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 0.95 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.11 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.09 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.21 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.435 HD12 ' HE2' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.45 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.11 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.2 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.464 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.19 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 50' ' ' THR . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.14 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.561 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.901 HG21 HD22 ' A' ' 46' ' ' LEU . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.19 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.655 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.89 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.19 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.879 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.2 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.642 HG21 HD22 ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.21 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.417 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.27 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.16 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.655 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 0.81 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.74 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 2.47 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 2.52 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.23 110.647 179.278 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.15 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.414 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.2 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.668 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.544 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.12 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.13 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.25 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 68' ' ' ALA . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.15 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 44' ' ' ILE . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.28 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.41 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.57 ' HB2' HD12 ' A' ' 81' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 1.66 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 2.37 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.571 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.18 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.52 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.486 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.48 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.09 109.723 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.548 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 110.449 -0.204 . . . . 1.72 110.449 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.43 112.88 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 1.39 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 0.71 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 26' ' ' LEU . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 0.5 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.632 HG21 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.35 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.37 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.12 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.728 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 0.88 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.499 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.53 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 0.49 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.15 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 0.94 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.605 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.11 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.13 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.76 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.29 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 0.96 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 10' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.66 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.444 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.34 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.675 HD13 ' HG ' ' A' ' 65' ' ' LEU . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 0.67 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.29 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 0.72 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.28 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.3 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.15 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 0.47 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.95 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' HD23 ' A' ' 43' ' ' LEU . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.11 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.09 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.21 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.45 111.31 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.579 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.11 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.647 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.2 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.422 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.19 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.14 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.45 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.19 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.68 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.89 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.19 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.2 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.554 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.565 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.21 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.27 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.16 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HA ' HD13 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 0.81 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.704 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 2.47 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 2.52 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.675 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.23 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.15 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.2 109.024 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.553 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.13 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 68' ' ' ALA . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.25 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.15 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.28 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.632 ' HB2' HG21 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.41 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.562 ' HB2' HD12 ' A' ' 81' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 1.66 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 2.37 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.562 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.18 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.464 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.48 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.09 109.84 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 110.836 -0.061 . . . . 1.72 110.836 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.43 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.612 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 1.39 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 0.71 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.768 HD11 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.5 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.485 ' HB ' HG12 ' A' ' 81' ' ' ILE . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.518 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.37 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.12 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.704 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.27 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 0.88 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.452 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.53 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 0.49 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.62 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.15 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.602 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 0.94 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.11 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.13 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.29 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 0.96 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.768 HD21 HD11 ' A' ' 10' ' ' LEU . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 0.66 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.34 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.612 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 0.67 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.29 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 0.72 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 35' ' ' LEU . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.28 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.593 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.3 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.15 112.467 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.604 HD11 HG23 ' A' ' 56' ' ' VAL . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 0.47 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.62 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 0.95 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.11 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.09 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.21 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.403 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.45 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.11 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.2 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.19 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 HG21 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.14 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.49 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.839 HG21 HD22 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.19 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.89 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.529 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.19 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.2 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.681 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.21 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.27 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.16 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.702 ' HA ' HD13 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 0.81 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 2.47 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 2.52 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.23 110.661 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.15 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.2 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.535 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.12 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.13 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.25 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 68' ' ' ALA . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.15 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.555 ' CG1' HD12 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.28 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.581 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.41 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.623 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 1.66 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 2.37 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.623 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.18 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.5 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.48 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.09 109.975 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.518 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.713 -0.106 . . . . 1.72 110.713 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.517 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.43 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 1.39 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 0.71 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 26' ' ' LEU . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 0.5 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.508 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.35 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.533 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.486 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.37 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.12 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.27 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 0.88 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.53 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 0.49 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.15 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.486 ' HG2' ' NZ ' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 0.94 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.11 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.13 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.29 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.96 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 10' ' ' LEU . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 0.66 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.521 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.34 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 65' ' ' LEU . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 0.67 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.29 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 0.72 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.47 ' CG ' HG22 ' A' ' 56' ' ' VAL . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.28 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.6 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.3 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.15 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 0.47 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 0.95 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.572 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.11 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.09 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.21 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.454 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.45 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.11 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.651 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.2 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.14 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.579 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.849 HG21 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.19 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.64 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 0.89 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.517 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.19 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.2 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.64 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.21 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.27 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.629 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.16 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 0.81 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 2.47 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.629 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 2.52 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.587 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.23 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.15 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.2 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.739 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.506 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.12 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.13 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.25 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 68' ' ' ALA . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.15 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.56 HG13 HD12 ' A' ' 44' ' ' ILE . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.28 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.41 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.595 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 1.66 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 2.37 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.18 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.506 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.48 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.09 110.054 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.533 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.436 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 111.148 0.055 . . . . 1.72 111.148 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.43 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 1.39 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.71 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 26' ' ' LEU . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 0.5 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.613 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.35 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.645 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.37 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.642 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.12 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.27 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 0.88 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.53 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 0.49 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.15 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.416 ' C ' HD12 ' A' ' 15' ' ' LEU . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 0.94 109.568 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.642 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.11 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.13 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.29 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.96 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 0.66 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.34 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 0.67 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.29 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.452 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 0.72 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.28 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.659 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.3 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.15 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 0.47 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.441 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.95 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.638 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.11 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.09 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.657 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.21 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.45 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.512 HD12 ' HE1' ' A' ' 69' ' ' PHE . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.11 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.2 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.19 111.215 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.908 HD22 HG21 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.14 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.555 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.662 ' H ' HD11 ' A' ' 66' ' ' LEU . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.908 HG21 HD22 ' A' ' 46' ' ' LEU . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.19 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.759 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 0.89 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.484 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.427 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.19 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.2 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.759 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.21 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.27 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.16 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.49 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 0.81 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.79 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 2.47 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 2.52 111.293 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.23 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.79 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.15 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.2 108.929 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.7 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.13 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.25 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.15 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.648 ' CG1' HD12 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.28 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.566 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.41 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 1.66 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 2.37 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.428 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.613 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.18 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.48 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.09 110.378 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.645 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.467 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.465 0.172 . . . . 1.72 111.465 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.43 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.522 ' NZ ' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 1.39 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.429 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 0.71 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 26' ' ' LEU . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 0.5 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.35 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.43 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.37 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.12 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.27 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 0.88 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.53 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 0.49 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.15 111.323 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 0.94 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.698 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.11 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.13 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.29 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.96 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 0.66 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.451 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.34 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.66 HD13 ' HG ' ' A' ' 65' ' ' LEU . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 0.67 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.464 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.29 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.631 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 0.72 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.6 ' CD2' HG13 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.28 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.735 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.3 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB1' ' HB3' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.15 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.666 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 0.47 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 0.95 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.11 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.09 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.21 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.515 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.45 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.666 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.11 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.662 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.2 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.19 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.815 HD22 HG21 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.14 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.522 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.815 HG21 HD22 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.19 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.623 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 0.89 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.19 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.6 ' HG3' HD12 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.2 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.407 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.21 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.27 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.16 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.608 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 0.81 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.727 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 2.47 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 2.52 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.66 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.23 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.15 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.2 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.766 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.12 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.13 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.25 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' ALA . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.15 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.491 ' CG1' HD12 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.28 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.527 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.41 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 1.66 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 2.37 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.545 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.18 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.48 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.09 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.432 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.513 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 111.461 0.171 . . . . 1.72 111.461 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.43 112.396 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.447 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 1.39 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.71 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 26' ' ' LEU . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 0.5 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.551 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.35 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.543 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.12 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.582 HD21 ' O ' ' A' ' 10' ' ' LEU . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.27 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 0.88 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.47 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.53 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 0.49 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.466 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.15 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.537 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 0.94 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.603 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.11 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.13 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.29 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 0.96 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 0.66 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.34 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.6 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 0.67 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.29 107.112 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 0.72 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.615 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.28 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.3 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.15 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 0.47 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 0.95 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.11 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.09 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.21 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.45 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.11 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.634 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.2 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.453 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 50' ' ' THR . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.14 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.479 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.471 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.938 HG21 HD22 ' A' ' 46' ' ' LEU . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.19 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 0.89 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.502 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.19 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.62 ' NZ ' HD13 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.2 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.21 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.27 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.519 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.16 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 0.81 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.754 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 2.47 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 2.52 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.6 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.23 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.15 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.2 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.509 ' HE1' HD12 ' A' ' 43' ' ' LEU . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.12 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.13 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.25 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 68' ' ' ALA . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.15 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.543 ' CG1' HD12 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.28 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.41 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.637 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 1.66 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 2.37 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.637 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.18 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.48 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.09 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.573 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.547 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 2.6 t30 . . . . . 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.737 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.43 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 1.39 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 0.71 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.663 ' HB3' HG22 ' A' ' 72' ' ' VAL . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.5 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.35 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' HD12 ' A' ' 16' ' ' LEU . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.37 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.693 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.12 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.542 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.27 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 0.88 110.078 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.496 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.53 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 0.49 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.15 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 0.94 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.693 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.11 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.13 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.29 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.96 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.706 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 0.66 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.34 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 0.67 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.29 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 0.72 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.585 ' CD2' HG13 ' A' ' 56' ' ' VAL . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.28 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.3 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.15 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 0.47 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.437 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 0.95 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.11 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.09 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.658 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.21 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.45 111.005 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.11 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.2 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.42 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.19 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 50' ' ' THR . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.14 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.629 ' O ' HD13 ' A' ' 51' ' ' LEU . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.613 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.941 HG21 HD22 ' A' ' 46' ' ' LEU . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.19 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.661 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 0.89 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.576 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.19 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.2 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.526 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.661 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 55' ' ' GLY . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.21 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.27 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.16 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 0.81 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 2.47 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 2.52 111.455 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.23 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.15 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.2 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.723 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.554 ' CE2' HD11 ' A' ' 51' ' ' LEU . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.12 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.13 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.25 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.15 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.48 ' CG1' HD12 ' A' ' 44' ' ' ILE . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.28 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.563 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.41 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.686 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 1.66 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 2.37 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.563 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.686 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.18 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.481 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.48 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.09 109.857 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.468 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.4 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 21.7 t-20 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.623 0.249 . . . . 1.72 111.133 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.43 113.257 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 1.39 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.417 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.71 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 26' ' ' LEU . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 0.5 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.547 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.35 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.37 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.12 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.713 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.27 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 0.88 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.53 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 0.49 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.15 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 0.94 109.52 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.11 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 28' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.13 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.29 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.273 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 10' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.66 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.34 111.002 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.672 HD23 ' HE2' ' A' ' 30' ' ' LYS . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 0.67 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.29 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.672 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 0.72 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.57 ' CD2' HG13 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.28 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.3 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.15 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 0.47 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 0.95 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.476 ' O ' HD23 ' A' ' 43' ' ' LEU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.11 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.09 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.639 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.21 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.45 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.11 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.2 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.19 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.14 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.467 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.898 HG21 HD22 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.19 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.669 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.89 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.19 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.2 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.21 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.476 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.27 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.566 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.16 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 0.81 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 2.47 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 2.52 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.23 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.15 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.2 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.72 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.534 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.12 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.13 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.25 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 68' ' ' ALA . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.15 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.529 ' CG1' HD12 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.28 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.691 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.41 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.613 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 1.66 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.691 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 2.37 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.613 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.18 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.48 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.09 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.583 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.461 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.607 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 33.7 m-80 . . . . . 0 CA--C 1.531 0.221 0 N-CA-C 111.347 0.128 . . . . 1.72 111.347 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.43 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.607 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 1.39 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 0.71 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 26' ' ' LEU . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 0.5 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.35 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.443 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.37 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.12 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.726 HD21 ' O ' ' A' ' 10' ' ' LEU . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.27 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 0.88 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.53 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 0.49 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.463 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.15 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.574 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 0.94 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.676 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.11 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.685 HD12 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.13 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.29 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 0.96 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 0.66 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.34 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.796 HD11 ' HB1' ' A' ' 61' ' ' ALA . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 0.67 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.29 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 0.72 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CD2' HG13 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.28 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.685 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.3 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.15 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 0.47 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.452 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 0.95 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.631 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.11 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.09 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.21 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.458 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.45 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.11 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.2 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.443 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.19 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.14 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.566 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.6 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.19 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 0.89 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.19 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.877 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.2 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.476 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.21 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.27 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.796 ' HB1' HD11 ' A' ' 28' ' ' LEU . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.16 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.579 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 2.47 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 2.52 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.526 HD11 ' HG ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.23 110.579 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.15 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.2 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.637 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.484 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.12 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.13 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.25 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.15 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.583 HG13 HD12 ' A' ' 44' ' ' ILE . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.28 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.55 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.41 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.548 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 1.66 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 2.37 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.18 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.513 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.48 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.09 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.59 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 111.831 0.308 . . . . 1.72 111.831 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.43 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 1.39 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.71 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 26' ' ' LEU . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.5 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.35 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB3' HD23 ' A' ' 15' ' ' LEU . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.462 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.37 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.12 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.659 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.27 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.88 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.53 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 0.49 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.15 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.573 ' SD ' ' HD2' ' A' ' 24' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 0.94 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.641 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.11 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.13 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.29 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.96 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 0.66 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.34 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.572 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 0.67 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.29 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 0.72 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.62 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.28 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.3 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.15 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 0.47 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 0.95 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.11 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.09 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.682 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.21 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.45 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.11 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.2 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.41 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.19 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.905 HD22 HG21 ' A' ' 50' ' ' THR . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.14 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.622 ' O ' HD13 ' A' ' 51' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.675 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.905 HG21 HD22 ' A' ' 46' ' ' LEU . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.19 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.89 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.608 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.19 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.2 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.415 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.709 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.21 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.46 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.27 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.16 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.608 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.746 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 2.47 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 2.52 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.23 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.15 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.2 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.12 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.13 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.25 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 68' ' ' ALA . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.15 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.741 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.28 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.41 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.741 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 1.66 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.561 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 2.37 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.518 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.18 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.523 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.48 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.09 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.478 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.556 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 111.322 0.119 . . . . 1.72 111.322 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.43 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 1.39 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 0.71 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 26' ' ' LEU . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 0.5 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.553 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.35 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.577 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.407 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.37 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.12 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.27 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 0.88 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.537 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.53 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 0.49 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.15 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.537 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 0.94 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.11 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.13 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.29 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.96 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.34 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.687 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 0.67 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.501 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.29 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.687 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 0.72 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CD2' HG13 ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.28 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.766 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.3 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.427 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.15 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.646 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 0.47 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 0.95 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.548 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.11 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.09 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.697 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.21 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.483 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.45 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.646 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.11 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.697 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.2 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.19 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.14 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.579 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.591 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.861 HG21 HD22 ' A' ' 46' ' ' LEU . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.19 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.679 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 0.89 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.611 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.44 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.19 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.2 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.21 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD1' HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.27 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.16 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.623 ' HA ' HD13 ' A' ' 51' ' ' LEU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.81 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 2.47 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 2.52 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.23 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.15 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.464 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.2 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.675 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.504 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.12 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.13 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.25 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 68' ' ' ALA . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.15 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.773 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.28 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.534 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.41 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 1.66 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 2.37 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.643 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.18 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.48 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.09 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.577 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.502 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.55 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.135 0.017 . . . . 1.72 110.976 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.758 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.43 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.758 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 1.39 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.71 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 26' ' ' LEU . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 0.5 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.554 HG21 ' CD2' ' A' ' 75' ' ' TYR . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.37 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.12 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.88 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.53 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 0.49 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.458 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.15 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 0.94 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.11 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD12 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.13 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.29 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 0.96 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 0.66 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.34 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 0.67 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.474 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.29 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 0.72 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.484 ' CG ' HG22 ' A' ' 56' ' ' VAL . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.28 110.88 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.705 ' HA ' HD12 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.3 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.15 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 0.47 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.95 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.11 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.09 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.659 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.21 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.466 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.45 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.11 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.19 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 50' ' ' THR . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.14 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.579 ' O ' HD13 ' A' ' 51' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.773 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.892 HG21 HD22 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.19 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.626 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 0.89 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HB3' ' HE2' ' A' ' 53' ' ' LYS . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HE2' ' HB3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.19 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.2 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.626 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.21 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.27 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.16 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 0.81 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 2.47 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 2.52 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.552 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.23 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.773 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.15 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.2 108.961 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.625 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.496 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.12 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.13 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.25 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 68' ' ' ALA . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.15 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.564 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.28 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.554 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.41 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.597 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 2.37 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.18 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.471 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.623 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.48 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.09 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.594 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 . . . . . 0 C--O 1.226 -0.181 0 N-CA-C 110.778 -0.082 . . . . 1.72 110.778 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.43 112.423 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 1.39 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.46 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 0.71 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 26' ' ' LEU . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.5 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.35 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.37 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.12 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.73 HD21 ' O ' ' A' ' 10' ' ' LEU . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.27 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 0.88 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.53 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 0.49 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.453 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.15 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.475 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 0.94 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.11 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.13 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.29 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 0.96 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 10' ' ' LEU . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 0.66 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.34 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 0.67 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.29 107.201 177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.831 ' HE3' HD23 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 0.72 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.608 ' CD2' HG13 ' A' ' 56' ' ' VAL . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.28 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.3 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.15 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 0.47 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 0.95 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.11 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.09 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.66 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.21 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.45 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.11 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.2 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.19 111.37 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 HG21 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.14 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.703 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.865 HG21 HD22 ' A' ' 46' ' ' LEU . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.19 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.68 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.89 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.581 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.457 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.19 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.2 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.68 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.21 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.471 HD12 ' NE ' ' A' ' 63' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.27 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.16 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.636 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 0.81 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 2.47 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 2.52 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.694 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.23 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.703 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.15 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.2 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.12 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.13 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.25 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.15 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.659 HG13 HD12 ' A' ' 44' ' ' ILE . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.28 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.562 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.41 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 1.66 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 2.37 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.433 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.576 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.18 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.501 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.48 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.09 110.129 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.584 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.51 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 110.464 -0.198 . . . . 1.72 110.464 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.778 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.43 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.778 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 1.39 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.44 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 0.71 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 26' ' ' LEU . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 0.5 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.518 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.35 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HA ' HD12 ' A' ' 16' ' ' LEU . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.37 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.12 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.674 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.27 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 0.88 110.147 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.53 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 0.49 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.436 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.15 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.569 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 0.94 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.11 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.13 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.29 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.96 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 10' ' ' LEU . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 0.66 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.34 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 0.67 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.625 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.29 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 0.72 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.607 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.28 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.3 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.15 112.488 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 0.47 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 0.95 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.598 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.11 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.09 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.656 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.21 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.534 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.45 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.11 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.2 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.843 HD22 HG21 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.14 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.469 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.612 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.932 HG22 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.19 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.673 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 0.89 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.51 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.19 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.932 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.2 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.21 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.446 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.27 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.16 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.621 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 0.81 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 2.47 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 2.52 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.23 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.15 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.2 108.813 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.495 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.12 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.13 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.25 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.15 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.504 HG12 HD12 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.28 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.41 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.534 ' NZ ' HD11 ' A' ' 41' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 1.66 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 2.37 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.18 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.48 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.09 109.742 178.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 90.3 m-20 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 119.986 -0.054 . . . . 1.72 110.887 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.43 111.885 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.556 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 1.39 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 0.71 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 26' ' ' LEU . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.5 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.548 HG21 ' CD2' ' A' ' 75' ' ' TYR . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.35 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.628 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.481 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.37 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.12 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.709 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.27 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 0.88 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.53 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.464 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 0.49 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.15 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.49 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 0.94 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.11 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.13 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.29 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 0.96 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 0.66 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.34 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.597 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 0.67 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.402 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.29 107.591 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' N ' ' C ' ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 0.72 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 56' ' ' VAL . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.28 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.683 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.3 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.15 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 31' ' ' TYR . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 0.47 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 0.95 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.458 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.11 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.09 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.754 ' HZ3' ' HZ2' ' A' ' 76' ' ' LYS . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.21 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.45 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.11 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 40' ' ' TRP . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.2 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.497 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.821 HD22 HG21 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.14 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.528 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.873 HG22 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.19 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HG21 ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.89 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.19 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.873 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.2 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.66 HG21 HD22 ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.525 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.21 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.543 HD13 ' HE ' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.27 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.16 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 0.81 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.743 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 2.47 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 2.52 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.597 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.23 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.15 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.403 ' HD2' HD11 ' A' ' 71' ' ' ILE . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.2 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.521 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.12 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.13 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.25 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 68' ' ' ALA . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.15 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.657 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.28 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.548 ' CD2' HG21 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.41 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.78 ' CB ' ' HZ3' ' A' ' 76' ' ' LYS . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 1.66 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 2.37 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.666 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.18 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.48 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.09 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.628 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.513 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 111.058 0.022 . . . . 1.72 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.43 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 1.39 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.551 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 0.71 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.924 HD21 HD11 ' A' ' 26' ' ' LEU . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.5 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.442 ' HB ' HG12 ' A' ' 81' ' ' ILE . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.35 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.37 109.312 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.12 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.27 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 0.88 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.423 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.53 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 0.49 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.15 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.477 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 0.94 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.11 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.13 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.29 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 0.96 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.924 HD11 HD21 ' A' ' 10' ' ' LEU . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 0.66 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.34 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 26' ' ' LEU . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 0.67 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.29 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 0.72 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 56' ' ' VAL . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.28 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.3 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.15 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 0.47 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.521 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 0.95 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.62 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.11 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.09 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.635 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.21 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.408 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.45 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.11 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.639 HG21 HG11 ' A' ' 72' ' ' VAL . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.2 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.19 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.94 HD22 HG21 ' A' ' 50' ' ' THR . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.14 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.503 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.94 HG21 HD22 ' A' ' 46' ' ' LEU . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.19 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.733 HD22 HD13 ' A' ' 65' ' ' LEU . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 0.89 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.539 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.19 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.917 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.2 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.419 ' O ' HD22 ' A' ' 57' ' ' LEU . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' ' 58' ' ' ALA . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.21 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.434 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.27 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.53 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.16 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.73 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 0.81 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 2.47 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 2.52 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.733 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.23 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.15 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.2 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.617 ' HB2' HD21 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.536 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.12 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.13 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.25 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.705 HG22 ' HB3' ' A' ' 10' ' ' LEU . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.15 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.539 ' CG1' HD12 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.28 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.553 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.41 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.647 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 1.66 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 2.37 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.553 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.647 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.18 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.495 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.483 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.48 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.09 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.5 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.497 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.519 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 111.286 0.106 . . . . 1.72 111.286 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.723 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.43 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.723 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 1.39 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 0.71 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.5 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.532 ' HB ' HG12 ' A' ' 81' ' ' ILE . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.35 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.582 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.37 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.699 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.12 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.563 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.27 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 0.88 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.484 ' HB3' ' HB2' ' A' ' 21' ' ' MET . 1.8 t-20 -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.53 109.225 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.563 HD11 ' CA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 0.49 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.425 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.15 110.983 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.484 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 0.94 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.699 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.11 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.13 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.29 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 0.96 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 0.66 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.501 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.34 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.882 HD23 ' HE3' ' A' ' 30' ' ' LYS . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 0.67 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.514 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.29 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.882 ' HE3' HD23 ' A' ' 28' ' ' LEU . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 0.72 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.28 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.686 ' HA ' HD12 ' A' ' 23' ' ' LEU . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.3 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.15 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.649 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 0.47 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 0.95 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.553 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.11 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.09 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.708 ' HZ3' ' HZ1' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.21 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.45 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.11 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 40' ' ' TRP . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.2 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.19 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.922 HD22 HG21 ' A' ' 50' ' ' THR . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.14 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.52 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.695 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.922 HG21 HD22 ' A' ' 46' ' ' LEU . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.19 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.89 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.19 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.2 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.643 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.21 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.42 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.27 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.16 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 0.81 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.714 ' HA ' HD12 ' A' ' 66' ' ' LEU . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 2.47 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 2.52 110.713 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.578 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.23 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.15 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.535 ' HD2' HD11 ' A' ' 71' ' ' ILE . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.2 108.746 179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.662 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.526 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.12 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.13 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD11 ' HD2' ' A' ' 67' ' ' LYS . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.25 110.951 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.15 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.63 ' CG1' HD12 ' A' ' 44' ' ' ILE . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.28 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.56 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.41 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.708 ' HZ1' ' HZ3' ' A' ' 40' ' ' TRP . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 1.66 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 2.37 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.56 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.626 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.18 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.457 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.48 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.09 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.582 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.441 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 120.839 0.352 . . . . 5.27 110.928 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.505 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 27.8 t-20 -91.85 -77.39 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 3.86 110.818 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.3 p 45.77 55.31 6.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.077 -0.51 . . . . 1.79 111.271 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.9 t -100.21 9.38 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 1.99 110.972 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.566 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER 56.56 85.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.004 -0.544 . . . . 1.22 111.22 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 -79.89 108.14 8.43 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 1.72 110.739 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.43 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.575 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 1.39 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 0.71 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 0.5 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.476 ' HB ' HG12 ' A' ' 81' ' ' ILE . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.35 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.545 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.532 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.37 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.668 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.12 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.27 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 0.88 110.03 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.53 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 0.49 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.401 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.15 110.34 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.598 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 0.94 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.668 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.11 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.13 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.757 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.29 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 0.96 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.66 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.34 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' ' 65' ' ' LEU . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.67 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.757 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.29 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 0.72 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CG ' HG22 ' A' ' 56' ' ' VAL . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.28 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.15 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 0.47 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 0.95 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.618 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.11 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.09 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.21 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.45 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.578 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.11 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.2 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.19 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 50' ' ' THR . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.14 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.573 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.687 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.852 HG21 HD22 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.19 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.663 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 0.89 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.629 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.19 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.2 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.417 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.417 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.21 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.461 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.27 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.16 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.65 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 0.81 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 2.47 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 2.52 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.23 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.15 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.2 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.686 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.501 ' HE1' HD12 ' A' ' 43' ' ' LEU . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.12 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.13 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.25 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 68' ' ' ALA . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.15 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.52 ' CG1' HD12 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.28 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.567 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.41 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.641 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 2.37 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.567 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.641 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.18 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.48 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.09 110.035 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 79.7 p . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.82 0.343 . . . . 5.27 110.903 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -164.6 135.67 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 3.86 110.837 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.617 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 30.8 t -73.08 84.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.163 -0.471 . . . . 1.79 110.961 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.4 t -136.9 8.54 3.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.99 110.748 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.55 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.2 OUTLIER 58.53 71.01 0.61 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.189 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t-20 -72.3 107.87 3.54 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.04 -0.527 . . . . 1.72 110.682 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.74 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.43 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 1.39 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.45 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 0.71 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 26' ' ' LEU . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.5 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.542 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.35 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.37 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.12 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 10' ' ' LEU . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.27 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.58 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 0.88 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.53 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 0.49 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.15 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.44 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 0.94 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.11 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.13 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.29 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 0.96 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.617 ' HB2' ' HB2' ' A' ' 3' ' ' SER . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.34 111.819 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 0.67 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.29 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HE3' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 0.72 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.582 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.28 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.697 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.3 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.424 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.15 112.544 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 56' ' ' VAL . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 0.47 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 32' ' ' SER . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 0.95 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.575 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.11 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.09 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.703 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.21 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.456 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.45 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.11 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.19 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.14 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.578 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.87 HG22 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.19 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 0.89 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.19 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.2 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.21 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.27 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.16 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 0.81 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 66' ' ' LEU . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 2.47 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.55 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 2.52 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.23 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.15 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.2 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.531 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.12 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.13 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.25 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.15 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.76 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.28 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.54 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.41 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 1.66 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 2.37 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.54 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.18 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.48 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.09 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.491 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 5.27 110.863 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -162.78 20.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 3.86 111.074 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.491 ' HB2' ' HG3' ' A' ' 27' ' ' ARG . 24.5 t 61.59 -82.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.137 -0.483 . . . . 1.79 110.919 -179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.4 m 61.26 99.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 1.99 111.334 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.524 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -59.02 99.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 1.22 110.26 179.429 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.632 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 18.8 m120 -84.19 106.17 7.5 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 1.72 111.538 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.43 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.632 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 1.39 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 0.71 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 26' ' ' LEU . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 0.5 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.571 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.35 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.37 109.576 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.12 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.744 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.27 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 0.88 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.438 ' OD1' ' HB2' ' A' ' 21' ' ' MET . 3.5 t-20 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 0.49 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.15 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.438 ' HB2' ' OD1' ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 0.94 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.69 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.11 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.13 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.29 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 0.96 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 0.66 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 3' ' ' SER . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.34 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 65' ' ' LEU . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 0.67 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.29 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 0.72 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.41 ' CG ' HG22 ' A' ' 56' ' ' VAL . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.28 110.369 179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.627 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.3 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.15 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 0.47 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 0.95 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.11 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.09 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.21 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.435 HD12 ' HE2' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.45 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.11 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.2 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.464 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.19 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 50' ' ' THR . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.14 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.561 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.901 HG21 HD22 ' A' ' 46' ' ' LEU . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.19 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.655 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.89 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.19 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.879 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.2 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.642 HG21 HD22 ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.21 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.417 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.27 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.16 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.655 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 0.81 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.74 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 2.47 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 2.52 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.23 110.647 179.278 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.15 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.414 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.2 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.668 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.544 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.12 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.13 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.25 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 68' ' ' ALA . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.15 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 44' ' ' ILE . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.28 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.41 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.57 ' HB2' HD12 ' A' ' 81' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 1.66 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 2.37 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.571 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.18 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.52 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.486 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.48 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.09 109.723 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.848 0.356 . . . . 5.27 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.4 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 15.8 t-20 -88.91 53.45 2.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 3.86 110.691 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 69.5 p -122.65 80.52 1.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 1.79 110.944 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -121.33 9.76 10.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 1.99 111.129 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.649 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.3 OUTLIER 57.49 85.16 0.09 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.15 -0.477 . . . . 1.22 111.34 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.548 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 -80.25 106.55 5.28 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.689 -0.232 . . . . 1.72 110.449 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 5' ' ' MET . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.43 112.88 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 1.39 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 0.71 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 26' ' ' LEU . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 0.5 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.632 HG21 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.35 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.37 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.12 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.728 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 0.88 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.499 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.53 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 0.49 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.15 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 0.94 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.605 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.11 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.13 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.76 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.29 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 0.96 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 10' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.66 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.477 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.34 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.675 HD13 ' HG ' ' A' ' 65' ' ' LEU . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 0.67 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.29 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 0.72 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.28 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.3 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.15 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 0.47 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.95 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' HD23 ' A' ' 43' ' ' LEU . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.11 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.09 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.21 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.45 111.31 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.579 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.11 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.647 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.2 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.422 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.19 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.14 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.45 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.19 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.68 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.89 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.19 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.2 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.554 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.565 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.21 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.27 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.16 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HA ' HD13 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 0.81 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.704 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 2.47 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.649 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 2.52 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.675 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.23 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.15 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.541 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.2 109.024 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.553 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.13 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 68' ' ' ALA . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.25 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.15 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.28 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.632 ' HB2' HG21 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.41 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.562 ' HB2' HD12 ' A' ' 81' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 1.66 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 2.37 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.562 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.18 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.464 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.48 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.09 109.84 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.3 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.758 0.313 . . . . 5.27 110.862 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -100.58 119.68 38.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 3.86 110.905 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.512 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 14.1 p -89.3 14.15 11.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 1.79 110.601 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 m -62.4 145.15 54.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 1.99 110.629 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.563 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -86.14 81.8 8.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.077 -0.511 . . . . 1.22 111.199 -179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 -65.21 105.75 0.84 Allowed Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 116.464 -0.335 . . . . 1.72 110.836 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.43 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.612 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 1.39 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 0.71 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.768 HD11 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.5 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.485 ' HB ' HG12 ' A' ' 81' ' ' ILE . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.518 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.37 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.12 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.704 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.27 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 0.88 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.452 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.53 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 0.49 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.62 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.15 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.602 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 0.94 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.11 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.13 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.29 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 0.96 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.768 HD21 HD11 ' A' ' 10' ' ' LEU . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 0.66 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.34 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.612 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 0.67 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.29 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 0.72 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 35' ' ' LEU . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.28 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.593 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.3 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.15 112.467 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.604 HD11 HG23 ' A' ' 56' ' ' VAL . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 0.47 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.62 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 0.95 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.11 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.09 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.21 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.403 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.45 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.11 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.2 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.19 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 HG21 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.14 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.49 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.839 HG21 HD22 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.19 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.89 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.529 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.19 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.2 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.681 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.21 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.27 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.16 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.702 ' HA ' HD13 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 0.81 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 2.47 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.563 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 2.52 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.23 110.661 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.15 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.2 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.535 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.12 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.13 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.25 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 68' ' ' ALA . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.15 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.555 ' CG1' HD12 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.28 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.581 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.41 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.623 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 1.66 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 2.37 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.623 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.18 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.5 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.48 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.09 109.975 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.518 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.874 0.369 . . . . 5.27 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -103.2 99.31 9.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 3.86 110.763 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.48 ' HB3' ' NE ' ' A' ' 27' ' ' ARG . 93.2 p -94.66 27.48 3.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.283 -0.417 . . . . 1.79 111.314 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -60.81 122.47 14.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.696 0.284 . . . . 1.99 110.676 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.621 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -71.79 78.68 0.86 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 1.22 111.008 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -66.73 107.68 1.83 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.222 -0.444 . . . . 1.72 110.713 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.517 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.43 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 1.39 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 0.71 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 26' ' ' LEU . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 0.5 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.508 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.35 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.533 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.486 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.37 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.12 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.27 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 0.88 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.53 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 0.49 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.15 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.486 ' HG2' ' NZ ' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 0.94 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.11 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.13 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.29 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.96 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 10' ' ' LEU . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 0.66 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.521 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.34 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 65' ' ' LEU . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 0.67 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.29 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 0.72 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.47 ' CG ' HG22 ' A' ' 56' ' ' VAL . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.28 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.6 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.3 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.15 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 0.47 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 0.95 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.572 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.11 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.09 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.21 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.454 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.45 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.11 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.651 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.2 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.14 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.579 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.849 HG21 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.19 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.64 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 0.89 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.517 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.19 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.2 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.64 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.21 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.27 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.629 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.16 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 0.81 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 2.47 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.629 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 2.52 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.587 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.23 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.15 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.2 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.739 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.506 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.12 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.13 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.25 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 68' ' ' ALA . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.15 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.56 HG13 HD12 ' A' ' 44' ' ' ILE . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.28 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.41 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.595 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 1.66 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 2.37 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.18 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.506 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.48 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.09 110.054 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.533 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.436 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.835 0.35 . . . . 5.27 110.825 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -121.69 172.45 8.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 3.86 110.996 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.5 m -94.43 48.46 1.23 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 1.79 111.054 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.7 m 55.91 56.49 5.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.081 -0.509 . . . . 1.99 111.513 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG2' ' HE3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -73.33 98.04 2.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.399 -0.364 . . . . 1.22 110.241 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -96.88 103.05 13.42 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 1.72 111.148 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 5' ' ' MET . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.43 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 1.39 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.71 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 26' ' ' LEU . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 0.5 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.613 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.35 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.645 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.37 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.642 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.12 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.27 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 0.88 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.53 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 0.49 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.15 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.416 ' C ' HD12 ' A' ' 15' ' ' LEU . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 0.94 109.568 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.642 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.11 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.13 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.29 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.96 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 0.66 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.34 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 0.67 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.29 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.452 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 0.72 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.28 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.659 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.3 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.15 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 0.47 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.441 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.95 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.638 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.11 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.09 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.657 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.21 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.45 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.512 HD12 ' HE1' ' A' ' 69' ' ' PHE . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.11 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.2 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.19 111.215 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.908 HD22 HG21 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.14 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.555 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.662 ' H ' HD11 ' A' ' 66' ' ' LEU . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.908 HG21 HD22 ' A' ' 46' ' ' LEU . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.19 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.759 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 0.89 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.427 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.19 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.2 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.759 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.21 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.27 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.16 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.49 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 0.81 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.79 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 2.47 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 2.52 111.293 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.23 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.79 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.15 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.477 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.2 108.929 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.7 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.13 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.25 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.15 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.648 ' CG1' HD12 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.28 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.566 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.41 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 1.66 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 2.37 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.613 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.18 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.48 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.09 110.378 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.645 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.467 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.2 m . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.791 0.329 . . . . 5.27 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -115.77 -169.2 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 3.86 110.919 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 4.1 p 56.26 27.69 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.139 -0.482 . . . . 1.79 110.59 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.3 m -85.3 16.22 3.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.945 -0.57 . . . . 1.99 111.451 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.483 ' HE3' ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER 58.61 78.01 0.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.325 -0.398 . . . . 1.22 110.92 -179.82 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 -75.79 109.69 8.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.225 -0.443 . . . . 1.72 111.465 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.43 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.522 ' NZ ' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 1.39 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.429 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 0.71 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 26' ' ' LEU . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 0.5 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.35 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.43 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.37 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.12 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.27 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 0.88 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.53 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 0.49 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.15 111.323 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 0.94 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.698 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.11 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.13 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.29 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.96 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 0.66 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.34 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.66 HD13 ' HG ' ' A' ' 65' ' ' LEU . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 0.67 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.464 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.29 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.631 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 0.72 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.6 ' CD2' HG13 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.28 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.735 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.3 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB1' ' HB3' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.15 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.666 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 0.47 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 0.95 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.11 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.09 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.21 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.515 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.45 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.666 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.11 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.662 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.2 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.19 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.815 HD22 HG21 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.14 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.522 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.815 HG21 HD22 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.19 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.623 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 0.89 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.19 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.6 ' HG3' HD12 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.2 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.21 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.27 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.16 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.608 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 0.81 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.727 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 2.47 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 2.52 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.66 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.23 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.15 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.2 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.766 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.12 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.13 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.25 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' ALA . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.15 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.491 ' CG1' HD12 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.28 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.527 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.41 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 1.66 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 2.37 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.545 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.18 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.48 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.09 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.432 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.766 0.317 . . . . 5.27 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -119.61 28.54 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 3.86 110.662 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -88.76 41.7 1.04 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 1.79 110.717 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 t -80.18 141.87 35.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.084 -0.507 . . . . 1.99 111.242 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.491 ' HG3' ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -84.19 82.36 8.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 1.22 110.783 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.513 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -70.26 109.11 4.27 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.357 -0.383 . . . . 1.72 111.461 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.43 112.396 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.447 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 1.39 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.71 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 26' ' ' LEU . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 0.5 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.551 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.35 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.543 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.12 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.582 HD21 ' O ' ' A' ' 10' ' ' LEU . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.27 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 0.88 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.53 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 0.49 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.466 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.15 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.537 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 0.94 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.603 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.11 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.13 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.29 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 0.96 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 0.66 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.34 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.6 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 0.67 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.29 107.112 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 0.72 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.615 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.28 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.3 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.15 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 0.47 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 0.95 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.11 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.09 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.21 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.45 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.11 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.634 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.2 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.453 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 50' ' ' THR . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.14 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.479 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.471 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.938 HG21 HD22 ' A' ' 46' ' ' LEU . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.19 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 0.89 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.502 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.19 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.62 ' NZ ' HD13 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.2 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.21 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.27 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.519 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.16 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 0.81 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.754 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 2.47 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 2.52 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.6 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.23 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.15 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.2 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.509 ' HE1' HD12 ' A' ' 43' ' ' LEU . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.12 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.13 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.25 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 68' ' ' ALA . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.15 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.543 ' CG1' HD12 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.28 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.41 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.637 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 1.66 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 2.37 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.637 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.18 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.48 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.09 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.573 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.547 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.849 0.357 . . . . 5.27 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -82.14 175.71 10.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 3.86 110.789 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.1 m -78.1 1.42 21.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 1.79 110.292 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 p 75.17 -49.15 0.64 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.411 -0.813 . . . . 1.99 111.94 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.61 ' HE1' ' H ' ' A' ' 68' ' ' ALA . 0.0 OUTLIER 65.98 -75.09 0.05 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.634 0.254 . . . . 1.22 110.747 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 2.6 t30 72.04 91.04 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 178.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.737 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.43 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 1.39 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 0.71 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.663 ' HB3' HG22 ' A' ' 72' ' ' VAL . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.5 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.35 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' HD12 ' A' ' 16' ' ' LEU . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.37 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.693 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.12 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.542 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.27 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 0.88 110.078 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.496 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.53 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 0.49 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.15 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 0.94 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.693 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.11 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.13 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.29 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.96 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.706 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 0.66 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.34 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 0.67 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.29 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 0.72 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.585 ' CD2' HG13 ' A' ' 56' ' ' VAL . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.28 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.3 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.15 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 0.47 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.437 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 0.95 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.11 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.09 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.658 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.21 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.45 111.005 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.11 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.2 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.42 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.19 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 50' ' ' THR . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.14 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.629 ' O ' HD13 ' A' ' 51' ' ' LEU . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.613 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.941 HG21 HD22 ' A' ' 46' ' ' LEU . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.19 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.661 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 0.89 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.576 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.19 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.2 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.526 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.661 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 55' ' ' GLY . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.21 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.27 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.16 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 0.81 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 2.47 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 2.52 111.455 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.23 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.15 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HB2' ' CE ' ' A' ' 5' ' ' MET . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.2 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.723 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.554 ' CE2' HD11 ' A' ' 51' ' ' LEU . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.12 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.13 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.25 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.15 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.48 ' CG1' HD12 ' A' ' 44' ' ' ILE . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.28 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.563 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.41 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.686 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 1.66 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 2.37 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.563 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.686 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.18 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.481 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.48 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.09 109.857 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.468 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.653 0.263 . . . . 5.27 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 60.54 63.63 1.32 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.144 -0.48 . . . . 3.86 111.012 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -92.67 7.33 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 1.79 110.216 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.8 t -63.41 154.21 32.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.709 -0.678 . . . . 1.99 111.308 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.564 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -77.85 103.72 7.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 1.22 110.479 179.527 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.4 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 21.7 t-20 -90.97 109.54 35.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.617 -0.265 . . . . 1.72 111.133 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' A' ' 5' ' ' MET . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.43 113.257 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 1.39 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.417 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.71 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 26' ' ' LEU . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 0.5 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.547 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.35 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.37 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.12 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.713 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.27 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 0.88 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.53 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 0.49 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.15 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 0.94 109.52 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.11 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 28' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.13 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.29 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.273 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 10' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.66 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.34 111.002 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.672 HD23 ' HE2' ' A' ' 30' ' ' LYS . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 0.67 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.29 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.672 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 0.72 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.57 ' CD2' HG13 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.28 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.3 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.15 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 0.47 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 0.95 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.476 ' O ' HD23 ' A' ' 43' ' ' LEU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.11 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.09 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.639 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.21 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.45 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.11 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.2 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.19 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.14 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.467 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.898 HG21 HD22 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.19 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.669 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.89 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.19 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.2 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.21 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.476 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.27 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.566 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.16 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 0.81 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 2.47 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 2.52 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.23 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.15 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.2 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.72 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.534 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.12 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.13 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.25 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 68' ' ' ALA . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.15 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.529 ' CG1' HD12 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.28 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.691 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.41 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.613 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 1.66 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.691 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 2.37 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.613 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.18 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.48 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.09 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.583 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.461 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.701 0.286 . . . . 5.27 110.857 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 56.57 -158.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.263 -0.426 . . . . 3.86 110.967 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 35.7 p 48.64 54.39 10.69 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.276 -0.42 . . . . 1.79 110.972 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 m -113.0 12.53 19.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.957 -0.565 . . . . 1.99 110.987 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.478 ' HA ' HD11 ' A' ' 10' ' ' LEU . 0.5 OUTLIER 58.04 59.71 3.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.979 -0.555 . . . . 1.22 111.265 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.607 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 33.7 m-80 -55.52 105.64 0.56 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 1.72 111.347 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.43 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.607 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 1.39 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 0.71 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 26' ' ' LEU . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 0.5 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.35 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.443 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.37 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.12 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD21 ' O ' ' A' ' 10' ' ' LEU . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.27 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 0.88 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.53 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 0.49 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.463 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.15 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.574 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 0.94 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.676 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.11 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.685 HD12 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.13 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.29 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 0.96 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 0.66 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.34 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.796 HD11 ' HB1' ' A' ' 61' ' ' ALA . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 0.67 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.29 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 0.72 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CD2' HG13 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.28 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.685 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.3 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.15 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 0.47 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.452 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 0.95 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.631 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.11 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.09 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.21 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.458 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.45 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.11 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.2 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.443 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.19 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.14 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.566 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.6 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.19 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 0.89 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.19 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.877 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.2 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.476 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.21 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.27 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.796 ' HB1' HD11 ' A' ' 28' ' ' LEU . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.16 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.579 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 2.47 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 2.52 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.526 HD11 ' HG ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.23 110.579 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.15 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.2 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.637 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.484 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.12 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.13 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.25 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.15 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.583 HG13 HD12 ' A' ' 44' ' ' ILE . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.28 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.55 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.41 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.548 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 1.66 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 2.37 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.18 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.513 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.48 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.09 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.59 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.845 0.355 . . . . 5.27 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -147.31 107.34 4.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 3.86 110.907 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.9 p -73.21 87.53 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 1.79 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.8 p -101.6 151.28 22.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.026 -0.533 . . . . 1.99 110.867 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.634 ' HB3' HD11 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.01 -63.33 1.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.252 -0.431 . . . . 1.22 111.055 -179.914 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 72.04 83.32 0.15 Allowed Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.928 -0.578 . . . . 1.72 111.831 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.43 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 1.39 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.71 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 26' ' ' LEU . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.5 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.35 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB3' HD23 ' A' ' 15' ' ' LEU . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.462 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.37 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.12 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.659 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.27 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.88 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.53 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 0.49 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.15 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.573 ' SD ' ' HD2' ' A' ' 24' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 0.94 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.641 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.11 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.13 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.29 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.96 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 0.66 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.34 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.572 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 0.67 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.29 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 0.72 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.62 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.28 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.3 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.15 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 0.47 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 0.95 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.11 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.09 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.682 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.21 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.45 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.11 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.2 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.41 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.19 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.905 HD22 HG21 ' A' ' 50' ' ' THR . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.14 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.622 ' O ' HD13 ' A' ' 51' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.675 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.905 HG21 HD22 ' A' ' 46' ' ' LEU . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.19 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.89 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.608 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.19 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.2 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.415 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.709 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.21 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.46 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.27 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.16 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.608 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.746 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 2.47 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 2.52 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.23 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.15 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.2 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.12 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.13 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.25 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 68' ' ' ALA . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.15 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.741 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.28 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.41 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.741 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 1.66 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.561 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 2.37 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.518 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.18 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.523 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.48 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.09 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.478 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.926 0.393 . . . . 5.27 110.922 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -142.37 65.99 1.34 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.175 -0.466 . . . . 3.86 110.842 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -88.3 79.37 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 1.79 110.648 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -89.59 141.64 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 1.99 111.277 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.501 ' HG3' ' HB2' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -93.27 83.76 4.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 1.22 110.575 179.763 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.556 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 -69.3 107.38 2.11 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.317 -0.401 . . . . 1.72 111.322 -179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.43 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 1.39 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 0.71 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 26' ' ' LEU . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 0.5 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.553 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.35 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.577 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.407 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.37 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.12 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.27 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 0.88 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.537 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.53 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 0.49 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.15 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.537 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 0.94 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.11 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.13 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.29 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.96 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.34 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.687 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 0.67 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.501 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.29 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.687 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 0.72 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CD2' HG13 ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.28 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.766 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.3 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.427 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.15 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.646 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 0.47 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 0.95 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.548 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.11 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.09 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.697 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.21 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.483 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.45 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.646 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.11 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.697 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.2 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.19 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.14 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.579 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.591 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.861 HG21 HD22 ' A' ' 46' ' ' LEU . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.19 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.679 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 0.89 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.611 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.44 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.19 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.2 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.21 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD1' HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.27 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.16 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.623 ' HA ' HD13 ' A' ' 51' ' ' LEU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.81 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 2.47 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 2.52 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.23 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.15 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.464 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.2 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.675 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.504 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.12 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.13 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.25 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 68' ' ' ALA . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.15 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.773 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.28 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.534 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.41 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 1.66 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 2.37 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.643 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.18 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.48 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.09 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.577 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.502 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.636 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 43.0 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.755 0.312 . . . . 5.27 110.941 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -170.34 136.61 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 3.86 111.071 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 78.0 p -90.3 110.84 21.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 1.79 110.681 179.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.4 m -107.76 1.35 22.88 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.421 -0.354 . . . . 1.99 111.534 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.56 59.85 2.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 1.22 111.257 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.55 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -58.14 108.35 1.26 Allowed Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.342 -0.39 . . . . 1.72 110.976 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.758 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.43 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.758 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 1.39 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.71 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 26' ' ' LEU . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 0.5 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.554 HG21 ' CD2' ' A' ' 75' ' ' TYR . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.37 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.12 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.88 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.53 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 0.49 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.458 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.15 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 0.94 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.11 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD12 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.13 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.29 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 0.96 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 0.66 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.636 ' HE ' ' HA ' ' A' ' 1' ' ' SER . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.34 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 0.67 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.474 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.29 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 0.72 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.484 ' CG ' HG22 ' A' ' 56' ' ' VAL . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.28 110.88 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.705 ' HA ' HD12 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.3 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.15 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 0.47 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.95 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.11 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.09 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.659 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.21 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.466 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.45 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.11 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.19 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 50' ' ' THR . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.14 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.579 ' O ' HD13 ' A' ' 51' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.773 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.892 HG21 HD22 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.19 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.626 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 0.89 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HB3' ' HE2' ' A' ' 53' ' ' LYS . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HE2' ' HB3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.19 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.2 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.626 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.21 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.27 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.16 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 0.81 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 2.47 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 2.52 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.552 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.23 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.773 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.15 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.2 108.961 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.625 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.496 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.12 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.13 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.25 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 68' ' ' ALA . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.15 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.564 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.28 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.554 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.41 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.597 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 2.37 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.18 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.471 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.623 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.48 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.09 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.594 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.805 0.336 . . . . 5.27 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.2 t30 55.03 85.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 3.86 111.068 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.5 t -55.33 -66.37 0.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.112 -0.495 . . . . 1.79 110.793 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.8 t 53.75 93.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 1.99 111.14 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.554 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER -50.4 98.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 1.22 111.086 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 -80.3 107.31 6.74 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.421 . . . . 1.72 110.778 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 5' ' ' MET . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.43 112.423 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 1.39 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.46 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 0.71 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 26' ' ' LEU . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.5 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.35 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.37 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.12 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.73 HD21 ' O ' ' A' ' 10' ' ' LEU . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.27 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 0.88 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.53 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 0.49 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.453 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.15 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.475 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 0.94 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.11 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.13 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.29 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 0.96 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 10' ' ' LEU . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 0.66 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.34 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 0.67 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.29 107.201 177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.831 ' HE3' HD23 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 0.72 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.608 ' CD2' HG13 ' A' ' 56' ' ' VAL . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.28 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.3 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.15 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 0.47 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 0.95 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.11 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.09 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.66 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.21 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.45 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.11 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.2 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.19 111.37 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 HG21 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.14 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.703 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.865 HG21 HD22 ' A' ' 46' ' ' LEU . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.19 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.68 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.89 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.581 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.457 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.19 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.2 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.68 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.21 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.471 HD12 ' NE ' ' A' ' 63' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.27 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.16 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.636 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 0.81 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 2.47 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.554 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 2.52 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.694 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.23 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.703 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.15 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.2 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.12 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.13 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.25 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.15 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.659 HG13 HD12 ' A' ' 44' ' ' ILE . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.28 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.562 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.41 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 1.66 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 2.37 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.433 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.576 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.18 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.501 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.48 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.09 110.129 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.584 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.51 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.836 0.351 . . . . 5.27 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -100.42 -178.05 3.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 3.86 110.843 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.684 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 31.4 p -162.09 32.82 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.49 . . . . 1.79 110.797 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.3 m -90.02 13.72 14.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 1.99 110.555 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.522 ' HA ' HD11 ' A' ' 10' ' ' LEU . 0.6 OUTLIER 60.08 72.99 0.5 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.61 -0.723 . . . . 1.22 111.412 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 -70.06 108.71 3.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 1.72 110.464 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.778 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.43 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.778 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 1.39 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.44 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 0.71 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 26' ' ' LEU . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 0.5 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.518 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.35 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HA ' HD12 ' A' ' 16' ' ' LEU . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.37 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.12 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.674 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.27 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 0.88 110.147 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.53 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 0.49 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.436 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.15 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.569 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 0.94 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.11 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.13 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.29 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.96 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 10' ' ' LEU . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 0.66 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.34 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 0.67 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.625 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.29 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 0.72 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.607 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.28 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.3 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.15 112.488 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 0.47 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 0.95 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.598 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.11 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.09 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.656 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.21 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.534 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.45 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.11 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.2 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.843 HD22 HG21 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.14 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.469 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.612 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.932 HG22 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.19 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.673 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 0.89 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.51 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.19 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.932 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.2 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.21 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.446 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.27 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.16 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.621 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 0.81 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 2.47 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 2.52 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.23 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.15 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.2 108.813 179.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.495 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.12 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.13 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.25 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.15 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.504 HG12 HD12 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.28 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.41 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.534 ' NZ ' HD11 ' A' ' 41' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 1.66 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 2.37 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.18 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.48 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.09 109.742 178.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.91 0.386 . . . . 5.27 110.864 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -111.62 171.23 7.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 3.86 110.827 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -59.84 -49.97 75.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 1.79 110.48 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 p -178.59 -70.31 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.024 -0.535 . . . . 1.99 111.102 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.696 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER 57.58 93.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.414 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 90.3 m-20 -109.14 103.82 53.4 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.972 -0.558 . . . . 1.72 110.887 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.43 111.885 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.556 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 1.39 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 0.71 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 26' ' ' LEU . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.5 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.548 HG21 ' CD2' ' A' ' 75' ' ' TYR . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.35 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.628 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.481 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.37 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.12 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.709 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.27 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 0.88 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.53 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.464 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 0.49 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.15 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.49 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 0.94 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.11 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.13 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.29 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 0.96 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 0.66 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.34 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.597 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 0.67 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.402 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.29 107.591 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' N ' ' C ' ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 0.72 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 56' ' ' VAL . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.28 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.683 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.3 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.15 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 31' ' ' TYR . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 0.47 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 0.95 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.458 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.11 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.09 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.754 ' HZ3' ' HZ2' ' A' ' 76' ' ' LYS . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.21 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.45 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.11 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 40' ' ' TRP . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.2 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.497 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.821 HD22 HG21 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.14 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.528 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.873 HG22 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.19 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HG21 ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.89 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.19 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.873 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.2 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.66 HG21 HD22 ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.525 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.21 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.543 HD13 ' HE ' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.27 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.16 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 0.81 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.743 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 2.47 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.696 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 2.52 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.597 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.23 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.15 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.68 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.2 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.521 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.12 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.13 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.25 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 68' ' ' ALA . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.15 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.657 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.28 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.548 ' CD2' HG21 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.41 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.78 ' CB ' ' HZ3' ' A' ' 76' ' ' LYS . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 1.66 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 2.37 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.666 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.18 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.48 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.09 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.628 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.513 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.786 0.326 . . . . 5.27 110.98 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -141.01 -176.96 4.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 3.86 110.886 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 77.4 p -150.42 72.49 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 1.79 110.703 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -85.72 131.8 34.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.99 110.981 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.576 ' HE2' ' HB2' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -83.85 107.53 16.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.066 -0.515 . . . . 1.22 110.797 179.657 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 -89.88 103.19 5.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 1.72 111.058 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 5' ' ' MET . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.43 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 1.39 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.551 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 0.71 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.924 HD21 HD11 ' A' ' 26' ' ' LEU . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.5 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.442 ' HB ' HG12 ' A' ' 81' ' ' ILE . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.35 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.37 109.312 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.12 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.27 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 0.88 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.423 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.53 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 0.49 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.15 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.477 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 0.94 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.11 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.13 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.29 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 0.96 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.924 HD11 HD21 ' A' ' 10' ' ' LEU . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 0.66 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.34 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 26' ' ' LEU . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 0.67 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.29 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 0.72 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 56' ' ' VAL . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.28 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.3 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.15 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 0.47 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.521 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 0.95 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.62 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.11 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.09 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.635 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.21 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.408 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.45 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.11 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.639 HG21 HG11 ' A' ' 72' ' ' VAL . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.2 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.19 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.94 HD22 HG21 ' A' ' 50' ' ' THR . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.14 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.503 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.94 HG21 HD22 ' A' ' 46' ' ' LEU . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.19 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.733 HD22 HD13 ' A' ' 65' ' ' LEU . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 0.89 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.539 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.19 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.917 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.2 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.419 ' O ' HD22 ' A' ' 57' ' ' LEU . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' ' 58' ' ' ALA . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.21 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.434 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.27 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.53 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.16 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.73 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 0.81 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 2.47 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 2.52 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.733 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.23 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.15 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.2 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.617 ' HB2' HD21 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.536 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.12 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.13 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.25 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.705 HG22 ' HB3' ' A' ' 10' ' ' LEU . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.15 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.539 ' CG1' HD12 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.28 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.553 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.41 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.647 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 1.66 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 2.37 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.553 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.647 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.18 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.495 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.483 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.48 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.09 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.5 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.497 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.796 0.331 . . . . 5.27 110.938 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.511 ' H ' ' HG2' ' A' ' 27' ' ' ARG . 66.1 t30 -135.24 23.99 3.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 3.86 110.864 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.486 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 71.7 p -86.52 74.72 9.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 1.79 110.752 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.2 m -85.69 1.91 47.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 1.99 111.186 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.582 ' HG2' ' HE2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER 56.74 61.84 2.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.999 -0.546 . . . . 1.22 110.913 -179.709 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.519 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 -57.43 107.44 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 1.72 111.286 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.723 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.43 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.723 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 1.39 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 0.71 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.5 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.532 ' HB ' HG12 ' A' ' 81' ' ' ILE . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.35 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.582 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.37 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.699 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.12 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.563 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.27 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 0.88 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.484 ' HB3' ' HB2' ' A' ' 21' ' ' MET . 1.8 t-20 -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.53 109.225 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.563 HD11 ' CA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 0.49 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.425 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.15 110.983 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.484 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 0.94 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.699 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.11 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.13 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.29 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 0.96 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 0.66 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.511 ' HG2' ' H ' ' A' ' 2' ' ' ASN . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.34 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.882 HD23 ' HE3' ' A' ' 30' ' ' LYS . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 0.67 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.514 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.29 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.882 ' HE3' HD23 ' A' ' 28' ' ' LEU . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 0.72 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.28 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.686 ' HA ' HD12 ' A' ' 23' ' ' LEU . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.3 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.15 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.649 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 0.47 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 0.95 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.553 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.11 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.09 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.708 ' HZ3' ' HZ1' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.21 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.45 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.11 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 40' ' ' TRP . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.2 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.19 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.922 HD22 HG21 ' A' ' 50' ' ' THR . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.14 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.52 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.695 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.922 HG21 HD22 ' A' ' 46' ' ' LEU . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.19 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.89 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.19 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.2 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.643 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.21 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.42 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.27 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.16 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 0.81 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.714 ' HA ' HD12 ' A' ' 66' ' ' LEU . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 2.47 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.462 ' HE3' ' HE1' ' A' ' 5' ' ' MET . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 2.52 110.713 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.578 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.23 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.15 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.582 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.2 108.746 179.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.662 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.526 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.12 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.13 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD11 ' HD2' ' A' ' 67' ' ' LYS . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.25 110.951 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.15 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.63 ' CG1' HD12 ' A' ' 44' ' ' ILE . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.28 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.56 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.41 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.708 ' HZ1' ' HZ3' ' A' ' 40' ' ' TRP . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 1.66 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 2.37 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.56 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.626 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.18 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.457 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.48 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.09 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.582 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.441 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 110.739 -0.097 . . . . 1.72 110.739 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.43 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.575 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 1.39 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 0.71 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 0.5 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.476 ' HB ' HG12 ' A' ' 81' ' ' ILE . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.35 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.545 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.532 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.37 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.668 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.12 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.27 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 0.88 110.03 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.53 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 0.49 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.401 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.15 110.34 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.598 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 0.94 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.668 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.11 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.13 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.757 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.29 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 0.96 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.66 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.34 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' ' 65' ' ' LEU . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.67 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.757 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.29 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 0.72 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CG ' HG22 ' A' ' 56' ' ' VAL . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.28 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.15 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 0.47 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 0.95 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.618 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.11 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.09 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.21 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.45 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.578 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.11 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.2 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.19 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 50' ' ' THR . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.14 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.573 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.687 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.852 HG21 HD22 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.19 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.663 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 0.89 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.629 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.19 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.2 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.417 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.417 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.21 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.461 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.27 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.16 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.65 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 0.81 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 2.47 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 2.52 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.23 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.15 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.2 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.686 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.501 ' HE1' HD12 ' A' ' 43' ' ' LEU . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.12 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.13 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.25 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 68' ' ' ALA . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.15 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.52 ' CG1' HD12 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.28 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.567 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.41 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.641 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 2.37 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.567 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.641 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.18 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.48 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.09 110.035 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.682 -0.118 . . . . 1.72 110.682 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.74 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.43 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 1.39 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.45 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 0.71 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 26' ' ' LEU . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.5 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.542 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.35 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.37 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.12 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 10' ' ' LEU . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.27 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.58 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 0.88 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.53 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 0.49 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.15 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.44 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 0.94 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.11 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.13 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.29 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 0.96 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.34 111.819 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 0.67 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.29 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HE3' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 0.72 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.582 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.28 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.697 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.3 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.424 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.15 112.544 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 56' ' ' VAL . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 0.47 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 32' ' ' SER . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 0.95 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.575 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.11 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.09 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.703 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.21 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.456 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.45 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.11 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.19 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.14 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.578 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.87 HG22 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.19 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 0.89 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.19 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.2 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.21 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.27 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.16 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 0.81 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 66' ' ' LEU . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 2.47 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 2.52 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.23 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.15 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.2 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.531 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.12 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.13 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.25 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.15 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.76 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.28 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.54 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.41 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 1.66 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 2.37 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.54 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.18 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.48 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.09 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.491 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.632 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 18.8 m120 . . . . . 0 CA--C 1.528 0.131 0 N-CA-C 111.538 0.199 . . . . 1.72 111.538 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.43 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.632 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 1.39 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 0.71 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 26' ' ' LEU . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 0.5 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.571 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.35 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.37 109.576 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.12 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.744 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.27 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 0.88 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.704 HD22 ' H ' ' A' ' 21' ' ' MET . 1.2 t30 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 0.49 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.15 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.704 ' H ' HD22 ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 0.94 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.69 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.11 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.13 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.29 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 0.96 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 0.66 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.34 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 65' ' ' LEU . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 0.67 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.29 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 0.72 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.41 ' CG ' HG22 ' A' ' 56' ' ' VAL . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.28 110.369 179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.627 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.3 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.15 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 0.47 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 0.95 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.11 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.09 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.21 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.435 HD12 ' HE2' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.45 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.11 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.2 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.464 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.19 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 50' ' ' THR . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.14 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.561 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.901 HG21 HD22 ' A' ' 46' ' ' LEU . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.19 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.655 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.89 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.19 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.879 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.2 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.642 HG21 HD22 ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.21 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.417 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.27 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.16 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.655 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 0.81 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.74 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 2.47 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 2.52 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.23 110.647 179.278 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.15 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.414 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.2 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.668 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.544 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.12 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.13 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.25 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 68' ' ' ALA . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.15 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 44' ' ' ILE . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.28 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.41 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.57 ' HB2' HD12 ' A' ' 81' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 1.66 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 2.37 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.571 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.18 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.52 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.486 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.48 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.09 109.723 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.548 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 110.449 -0.204 . . . . 1.72 110.449 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.43 112.88 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 1.39 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 0.71 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 26' ' ' LEU . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 0.5 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.632 HG21 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.35 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.37 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.12 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.728 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 0.88 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.499 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.53 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 0.49 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.15 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 0.94 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.605 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.11 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.13 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.76 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.29 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 0.96 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 10' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.66 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.444 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.34 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.675 HD13 ' HG ' ' A' ' 65' ' ' LEU . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 0.67 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.29 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 0.72 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.28 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.3 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.15 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 0.47 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.95 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' HD23 ' A' ' 43' ' ' LEU . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.11 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.09 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.21 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.45 111.31 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.579 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.11 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.647 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.2 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.422 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.19 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.14 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.45 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.19 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.68 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.89 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.19 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.2 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.554 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.565 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.21 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.27 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.16 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HA ' HD13 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 0.81 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.704 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 2.47 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 2.52 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.675 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.23 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.15 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.2 109.024 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.553 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.13 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 68' ' ' ALA . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.25 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.15 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.28 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.632 ' HB2' HG21 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.41 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.562 ' HB2' HD12 ' A' ' 81' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 1.66 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 2.37 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.562 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.18 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.464 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.48 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.09 109.84 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 110.836 -0.061 . . . . 1.72 110.836 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.43 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.612 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 1.39 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 0.71 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.768 HD11 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.5 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.485 ' HB ' HG12 ' A' ' 81' ' ' ILE . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.518 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.37 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.12 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.704 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.27 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 0.88 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.452 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.53 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 0.49 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.62 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.15 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.602 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 0.94 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.11 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.13 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.29 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 0.96 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.768 HD21 HD11 ' A' ' 10' ' ' LEU . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 0.66 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.34 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.612 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 0.67 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.29 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 0.72 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 35' ' ' LEU . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.28 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.593 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.3 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.15 112.467 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.604 HD11 HG23 ' A' ' 56' ' ' VAL . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 0.47 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.62 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 0.95 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.11 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.09 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.21 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.403 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.45 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.11 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.2 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.19 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 HG21 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.14 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.49 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.839 HG21 HD22 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.19 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.89 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.529 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.19 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.2 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.681 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.21 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.27 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.16 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.702 ' HA ' HD13 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 0.81 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 2.47 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 2.52 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.23 110.661 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.15 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.2 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.535 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.12 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.13 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.25 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 68' ' ' ALA . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.15 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.555 ' CG1' HD12 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.28 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.581 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.41 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.623 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 1.66 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 2.37 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.623 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.18 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.5 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.48 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.09 109.975 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.518 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.713 -0.106 . . . . 1.72 110.713 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.517 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.43 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 1.39 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 0.71 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 26' ' ' LEU . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 0.5 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.508 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.35 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.533 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.486 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.37 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.12 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.27 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 0.88 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.53 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 0.49 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.15 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.486 ' HG2' ' NZ ' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 0.94 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.11 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.13 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.29 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.96 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 10' ' ' LEU . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 0.66 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.521 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.34 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 65' ' ' LEU . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 0.67 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.29 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 0.72 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.47 ' CG ' HG22 ' A' ' 56' ' ' VAL . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.28 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.6 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.3 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.15 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 0.47 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 0.95 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.572 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.11 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.09 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.21 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.454 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.45 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.11 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.651 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.2 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.14 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.579 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.849 HG21 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.19 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.64 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 0.89 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.517 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.19 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.2 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.64 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.21 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.27 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.629 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.16 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 0.81 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 2.47 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.629 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 2.52 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.587 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.23 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.15 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.2 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.739 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.506 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.12 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.13 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.25 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 68' ' ' ALA . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.15 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.56 HG13 HD12 ' A' ' 44' ' ' ILE . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.28 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.41 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.595 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 1.66 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 2.37 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.18 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.506 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.48 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.09 110.054 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.533 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.436 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 111.148 0.055 . . . . 1.72 111.148 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.43 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 1.39 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.71 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 26' ' ' LEU . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 0.5 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.613 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.35 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.645 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.37 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.642 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.12 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.27 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 0.88 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.53 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 0.49 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.15 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.416 ' C ' HD12 ' A' ' 15' ' ' LEU . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 0.94 109.568 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.642 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.11 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.13 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.29 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.96 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 0.66 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.34 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 0.67 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.29 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.452 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 0.72 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.28 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.659 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.3 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.15 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 0.47 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.441 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.95 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.638 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.11 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.09 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.657 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.21 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.45 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.512 HD12 ' HE1' ' A' ' 69' ' ' PHE . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.11 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.2 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.19 111.215 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.908 HD22 HG21 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.14 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.555 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.662 ' H ' HD11 ' A' ' 66' ' ' LEU . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.908 HG21 HD22 ' A' ' 46' ' ' LEU . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.19 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.759 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 0.89 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.484 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.427 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.19 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.2 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.759 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.21 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.27 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.16 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.49 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 0.81 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.79 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 2.47 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 2.52 111.293 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.23 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.79 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.15 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.2 108.929 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.7 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.13 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.25 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.15 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.648 ' CG1' HD12 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.28 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.566 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.41 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 1.66 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 2.37 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.428 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.613 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.18 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.48 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.09 110.378 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.645 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.467 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.465 0.172 . . . . 1.72 111.465 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.43 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.522 ' NZ ' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 1.39 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.429 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 0.71 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 26' ' ' LEU . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 0.5 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.35 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.43 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.37 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.12 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.27 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 0.88 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.53 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 0.49 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.15 111.323 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 0.94 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.698 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.11 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.13 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.29 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.96 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 0.66 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.451 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.34 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.66 HD13 ' HG ' ' A' ' 65' ' ' LEU . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 0.67 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.464 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.29 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.631 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 0.72 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.6 ' CD2' HG13 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.28 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.735 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.3 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB1' ' HB3' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.15 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.666 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 0.47 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 0.95 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.11 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.09 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.21 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.515 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.45 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.666 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.11 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.662 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.2 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.19 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.815 HD22 HG21 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.14 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.522 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.815 HG21 HD22 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.19 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.623 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 0.89 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.19 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.6 ' HG3' HD12 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.2 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.407 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.21 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.27 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.16 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.608 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 0.81 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.727 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 2.47 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 2.52 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.66 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.23 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.15 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.2 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.766 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.12 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.13 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.25 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' ALA . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.15 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.491 ' CG1' HD12 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.28 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.527 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.41 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 1.66 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 2.37 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.545 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.18 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.48 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.09 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.432 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.513 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 . . . . . 0 CA--C 1.532 0.268 0 N-CA-C 111.461 0.171 . . . . 1.72 111.461 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.43 112.396 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.447 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 1.39 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.71 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 26' ' ' LEU . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 0.5 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.551 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.35 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.543 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.12 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.582 HD21 ' O ' ' A' ' 10' ' ' LEU . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.27 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 0.88 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.47 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.53 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 0.49 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.466 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.15 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.537 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 0.94 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.603 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.11 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.13 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.29 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 0.96 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 0.66 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.34 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.6 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 0.67 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.29 107.112 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 0.72 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.615 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.28 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.3 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.15 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 0.47 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 0.95 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.11 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.09 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.21 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.45 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.11 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.634 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.2 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.453 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 50' ' ' THR . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.14 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.479 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.471 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.938 HG21 HD22 ' A' ' 46' ' ' LEU . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.19 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 0.89 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.502 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.19 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.62 ' NZ ' HD13 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.2 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.21 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.27 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.519 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.16 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 0.81 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.754 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 2.47 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 2.52 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.6 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.23 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.15 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.2 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.509 ' HE1' HD12 ' A' ' 43' ' ' LEU . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.12 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.13 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.25 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 68' ' ' ALA . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.15 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.543 ' CG1' HD12 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.28 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.41 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.637 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 1.66 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 2.37 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.637 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.18 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.48 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.09 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.573 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.547 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.737 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.43 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 1.39 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 0.71 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.663 ' HB3' HG22 ' A' ' 72' ' ' VAL . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.5 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.35 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' HD12 ' A' ' 16' ' ' LEU . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.37 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.693 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.12 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.542 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.27 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 0.88 110.078 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.496 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.53 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 0.49 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.15 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 0.94 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.693 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.11 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.13 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.29 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.96 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.706 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 0.66 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.34 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 0.67 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.29 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 0.72 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.585 ' CD2' HG13 ' A' ' 56' ' ' VAL . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.28 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.3 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.15 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 0.47 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.437 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 0.95 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.11 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.09 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.658 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.21 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.45 111.005 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.11 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.2 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.42 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.19 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 50' ' ' THR . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.14 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.629 ' O ' HD13 ' A' ' 51' ' ' LEU . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.613 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.941 HG21 HD22 ' A' ' 46' ' ' LEU . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.19 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.661 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 0.89 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.576 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.19 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.2 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.526 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.661 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 55' ' ' GLY . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.21 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.27 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.16 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 0.81 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 2.47 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 2.52 111.455 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.23 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.15 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.2 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.723 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.554 ' CE2' HD11 ' A' ' 51' ' ' LEU . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.12 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.13 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.25 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.15 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.48 ' CG1' HD12 ' A' ' 44' ' ' ILE . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.28 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.563 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.41 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.686 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 1.66 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 2.37 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.563 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.686 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.18 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.481 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.48 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.09 109.857 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.468 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.4 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 21.7 t-20 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.623 0.249 . . . . 1.72 111.133 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.43 113.257 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 1.39 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.417 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.71 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 26' ' ' LEU . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 0.5 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.547 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.35 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.37 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.12 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.713 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.27 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 0.88 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.53 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 0.49 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.15 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 0.94 109.52 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.11 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 28' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.13 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.29 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.273 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 10' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.66 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.34 111.002 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.672 HD23 ' HE2' ' A' ' 30' ' ' LYS . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 0.67 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.29 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.672 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 0.72 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.57 ' CD2' HG13 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.28 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.3 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.15 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 0.47 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 0.95 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.476 ' O ' HD23 ' A' ' 43' ' ' LEU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.11 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.09 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.639 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.21 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.45 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.11 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.2 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.19 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.14 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.467 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.898 HG21 HD22 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.19 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.669 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.89 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.19 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.2 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.21 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.476 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.27 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.566 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.16 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 0.81 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 2.47 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 2.52 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.23 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.15 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.2 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.72 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.534 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.12 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.13 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.25 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 68' ' ' ALA . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.15 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.529 ' CG1' HD12 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.28 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.691 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.41 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.613 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 1.66 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.691 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 2.37 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.613 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.18 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.48 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.09 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.583 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.461 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.607 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 16.0 m120 . . . . . 0 CA--C 1.531 0.221 0 N-CA-C 111.347 0.128 . . . . 1.72 111.347 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.43 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.607 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 1.39 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 0.71 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 26' ' ' LEU . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 0.5 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.35 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.443 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.37 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.12 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.726 HD21 ' O ' ' A' ' 10' ' ' LEU . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.27 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 0.88 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.53 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 0.49 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.463 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.15 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.574 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 0.94 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.676 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.11 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.685 HD12 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.13 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.29 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 0.96 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 0.66 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.34 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.796 HD11 ' HB1' ' A' ' 61' ' ' ALA . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 0.67 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.29 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 0.72 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CD2' HG13 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.28 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.685 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.3 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.15 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 0.47 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.452 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 0.95 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.631 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.11 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.09 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.21 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.458 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.45 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.11 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.2 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.443 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.19 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.14 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.566 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.6 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.19 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 0.89 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.19 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.877 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.2 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.476 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.21 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.27 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.796 ' HB1' HD11 ' A' ' 28' ' ' LEU . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.16 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.579 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 2.47 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 2.52 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.526 HD11 ' HG ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.23 110.579 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.15 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.2 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.637 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.484 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.12 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.13 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.25 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.15 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.583 HG13 HD12 ' A' ' 44' ' ' ILE . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.28 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.55 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.41 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.548 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 1.66 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 2.37 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.18 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.513 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.48 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.09 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.59 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 111.831 0.308 . . . . 1.72 111.831 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.43 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 1.39 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.71 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 26' ' ' LEU . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.5 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.35 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB3' HD23 ' A' ' 15' ' ' LEU . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.462 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.37 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.12 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.659 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.27 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.88 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.53 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 0.49 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.15 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.573 ' SD ' ' HD2' ' A' ' 24' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 0.94 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.641 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.11 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.13 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.29 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.96 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 0.66 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.34 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.572 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 0.67 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.29 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 0.72 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.62 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.28 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.3 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.15 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 0.47 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 0.95 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.11 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.09 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.682 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.21 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.45 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.11 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.2 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.41 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.19 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.905 HD22 HG21 ' A' ' 50' ' ' THR . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.14 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.622 ' O ' HD13 ' A' ' 51' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.675 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.905 HG21 HD22 ' A' ' 46' ' ' LEU . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.19 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.89 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.608 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.19 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.2 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.415 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.709 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.21 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.46 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.27 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.16 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.608 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.746 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 2.47 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 2.52 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.23 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.15 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.2 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.12 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.13 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.25 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 68' ' ' ALA . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.15 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.741 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.28 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.41 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.741 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 1.66 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.561 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 2.37 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.518 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.18 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.523 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.48 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.09 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.478 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.556 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 111.322 0.119 . . . . 1.72 111.322 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.43 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 1.39 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 0.71 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 26' ' ' LEU . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 0.5 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.553 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.35 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.577 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.407 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.37 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.12 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.27 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 0.88 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.537 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.53 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 0.49 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.15 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.537 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 0.94 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.11 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.13 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.29 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.96 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.34 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.687 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 0.67 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.501 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.29 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.687 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 0.72 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CD2' HG13 ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.28 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.766 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.3 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.427 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.15 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.646 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 0.47 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 0.95 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.548 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.11 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.09 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.697 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.21 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.483 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.45 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.646 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.11 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.697 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.2 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.19 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.14 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.579 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.591 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.861 HG21 HD22 ' A' ' 46' ' ' LEU . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.19 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.679 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 0.89 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.611 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.44 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.19 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.2 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.21 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD1' HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.27 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.16 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.623 ' HA ' HD13 ' A' ' 51' ' ' LEU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.81 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 2.47 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 2.52 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.23 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.15 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.464 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.2 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.675 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.504 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.12 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.13 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.25 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 68' ' ' ALA . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.15 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.773 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.28 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.534 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.41 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 1.66 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 2.37 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.643 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.18 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.48 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.09 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.577 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.502 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.55 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.135 0.017 . . . . 1.72 110.976 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.758 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.43 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.758 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 1.39 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.71 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 26' ' ' LEU . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 0.5 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.554 HG21 ' CD2' ' A' ' 75' ' ' TYR . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.37 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.12 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.88 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.53 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 0.49 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.458 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.15 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 0.94 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.11 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD12 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.13 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.29 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 0.96 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 0.66 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.34 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 0.67 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.474 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.29 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 0.72 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.484 ' CG ' HG22 ' A' ' 56' ' ' VAL . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.28 110.88 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.705 ' HA ' HD12 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.3 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.15 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 0.47 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.95 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.11 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.09 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.659 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.21 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.466 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.45 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.11 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.19 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 50' ' ' THR . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.14 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.579 ' O ' HD13 ' A' ' 51' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.773 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.892 HG21 HD22 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.19 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.626 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 0.89 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HB3' ' HE2' ' A' ' 53' ' ' LYS . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HE2' ' HB3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.19 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.2 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.626 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.21 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.27 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.16 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 0.81 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 2.47 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 2.52 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.552 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.23 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.773 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.15 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.2 108.961 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.625 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.496 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.12 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.13 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.25 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 68' ' ' ALA . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.15 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.564 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.28 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.554 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.41 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.597 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 2.37 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.18 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.471 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.623 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.48 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.09 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.594 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 . . . . . 0 C--O 1.226 -0.181 0 N-CA-C 110.778 -0.082 . . . . 1.72 110.778 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.43 112.423 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 1.39 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.46 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 0.71 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 26' ' ' LEU . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.5 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.35 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.37 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.12 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.73 HD21 ' O ' ' A' ' 10' ' ' LEU . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.27 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 0.88 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.53 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 0.49 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.453 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.15 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.475 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 0.94 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.11 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.13 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.29 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 0.96 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 10' ' ' LEU . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 0.66 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.34 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 0.67 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.29 107.201 177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.831 ' HE3' HD23 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 0.72 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.608 ' CD2' HG13 ' A' ' 56' ' ' VAL . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.28 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.3 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.15 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 0.47 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 0.95 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.11 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.09 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.66 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.21 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.45 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.11 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.2 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.19 111.37 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 HG21 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.14 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.703 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.865 HG21 HD22 ' A' ' 46' ' ' LEU . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.19 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.68 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.89 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.581 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.457 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.19 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.2 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.68 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.21 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.471 HD12 ' NE ' ' A' ' 63' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.27 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.16 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.636 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 0.81 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 2.47 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 2.52 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.694 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.23 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.703 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.15 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.2 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.12 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.13 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.25 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.15 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.659 HG13 HD12 ' A' ' 44' ' ' ILE . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.28 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.562 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.41 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 1.66 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 2.37 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.433 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.576 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.18 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.501 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.48 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.09 110.129 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.584 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.51 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 110.464 -0.198 . . . . 1.72 110.464 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.778 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.43 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.778 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 1.39 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.44 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 0.71 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 26' ' ' LEU . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 0.5 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.518 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.35 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HA ' HD12 ' A' ' 16' ' ' LEU . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.37 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.12 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.674 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.27 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 0.88 110.147 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.53 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 0.49 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.436 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.15 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.569 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 0.94 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.11 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.13 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.29 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.96 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 10' ' ' LEU . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 0.66 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.34 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.635 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 0.67 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.625 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.29 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 0.72 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.607 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.28 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.3 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.15 112.488 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 0.47 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 0.95 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.598 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.11 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.09 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.656 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.21 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.534 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.45 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.11 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.2 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.843 HD22 HG21 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.14 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.469 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.612 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.932 HG22 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.19 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.673 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 0.89 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.51 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.19 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.932 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.2 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.21 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.446 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.27 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.16 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.621 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 0.81 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 2.47 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 2.52 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.23 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.15 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.2 108.813 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.495 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.12 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.13 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.25 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.15 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.504 HG12 HD12 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.28 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.41 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.534 ' NZ ' HD11 ' A' ' 41' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 1.66 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 2.37 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.18 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.48 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.09 109.742 178.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.2 m120 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 119.986 -0.054 . . . . 1.72 110.887 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.43 111.885 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.556 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 1.39 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 0.71 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 26' ' ' LEU . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.5 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.548 HG21 ' CD2' ' A' ' 75' ' ' TYR . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.35 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.628 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.481 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.37 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.12 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.709 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.27 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 0.88 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.53 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.464 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 0.49 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.15 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.49 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 0.94 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.11 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.13 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.29 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 0.96 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 0.66 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.34 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.597 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 0.67 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.402 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.29 107.591 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' N ' ' C ' ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 0.72 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 56' ' ' VAL . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.28 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.683 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.3 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.15 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 31' ' ' TYR . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 0.47 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 0.95 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.458 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.11 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.09 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.754 ' HZ3' ' HZ2' ' A' ' 76' ' ' LYS . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.21 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.45 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.11 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 40' ' ' TRP . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.2 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.497 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.821 HD22 HG21 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.14 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.528 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.873 HG22 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.19 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HG21 ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.89 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.19 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.873 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.2 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.66 HG21 HD22 ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.525 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.21 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.543 HD13 ' HE ' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.27 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.16 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 0.81 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.743 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 2.47 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 2.52 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.597 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.23 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.15 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.403 ' HD2' HD11 ' A' ' 71' ' ' ILE . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.2 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.521 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.12 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.13 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.25 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 68' ' ' ALA . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.15 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.657 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.28 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.548 ' CD2' HG21 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.41 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.78 ' CB ' ' HZ3' ' A' ' 76' ' ' LYS . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 1.66 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 2.37 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.666 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.18 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.48 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.09 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.628 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.513 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 111.058 0.022 . . . . 1.72 111.058 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.43 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 1.39 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.551 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 0.71 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.924 HD21 HD11 ' A' ' 26' ' ' LEU . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.5 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.442 ' HB ' HG12 ' A' ' 81' ' ' ILE . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.35 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.37 109.312 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.12 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.27 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 0.88 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.423 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.53 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 0.49 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.15 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.477 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 0.94 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.11 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.13 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.29 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 0.96 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.924 HD11 HD21 ' A' ' 10' ' ' LEU . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 0.66 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.34 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 26' ' ' LEU . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 0.67 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.29 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 0.72 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 56' ' ' VAL . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.28 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.3 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.15 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 0.47 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.521 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 0.95 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.62 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.11 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.09 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.635 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.21 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.408 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.45 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.11 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.639 HG21 HG11 ' A' ' 72' ' ' VAL . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.2 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.19 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.94 HD22 HG21 ' A' ' 50' ' ' THR . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.14 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.503 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.94 HG21 HD22 ' A' ' 46' ' ' LEU . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.19 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.733 HD22 HD13 ' A' ' 65' ' ' LEU . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 0.89 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.539 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.19 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.917 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.2 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.419 ' O ' HD22 ' A' ' 57' ' ' LEU . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' ' 58' ' ' ALA . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.21 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.434 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.27 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.53 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.16 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.73 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 0.81 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 2.47 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 2.52 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.733 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.23 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.15 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.2 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.617 ' HB2' HD21 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.536 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.12 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.13 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.25 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.705 HG22 ' HB3' ' A' ' 10' ' ' LEU . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.15 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.539 ' CG1' HD12 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.28 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.553 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.41 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.647 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 1.66 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 2.37 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.553 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.647 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.18 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.495 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.483 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.48 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.09 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.5 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.497 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.519 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 111.286 0.106 . . . . 1.72 111.286 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.723 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.43 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.723 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 1.39 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 0.71 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.5 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.532 ' HB ' HG12 ' A' ' 81' ' ' ILE . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.35 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.582 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.37 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.699 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.12 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.563 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.27 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 0.88 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.511 HD22 ' H ' ' A' ' 21' ' ' MET . 0.8 OUTLIER -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.53 109.225 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.563 HD11 ' CA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 0.49 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.425 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.15 110.983 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.511 ' H ' HD22 ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 0.94 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.699 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.11 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.13 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.29 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 0.96 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 0.66 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.501 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.34 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.882 HD23 ' HE3' ' A' ' 30' ' ' LYS . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 0.67 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.514 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.29 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.882 ' HE3' HD23 ' A' ' 28' ' ' LEU . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 0.72 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.28 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.686 ' HA ' HD12 ' A' ' 23' ' ' LEU . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.3 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.15 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.649 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 0.47 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 0.95 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.553 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.11 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.09 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.708 ' HZ3' ' HZ1' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.21 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.45 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.11 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 40' ' ' TRP . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.2 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.19 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.922 HD22 HG21 ' A' ' 50' ' ' THR . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.14 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.52 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.695 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.922 HG21 HD22 ' A' ' 46' ' ' LEU . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.19 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.89 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.19 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.2 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.643 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.21 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.42 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.27 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.16 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 0.81 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.714 ' HA ' HD12 ' A' ' 66' ' ' LEU . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 2.47 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 2.52 110.713 179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.578 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.23 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.15 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.535 ' HD2' HD11 ' A' ' 71' ' ' ILE . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.2 108.746 179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.662 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.526 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.12 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.13 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD11 ' HD2' ' A' ' 67' ' ' LYS . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.25 110.951 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.15 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.63 ' CG1' HD12 ' A' ' 44' ' ' ILE . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.28 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.56 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.41 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.708 ' HZ1' ' HZ3' ' A' ' 40' ' ' TRP . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 1.66 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 2.37 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.56 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.626 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.18 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.457 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.48 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.09 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.582 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.441 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 120.839 0.352 . . . . 5.27 110.928 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.505 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 27.8 t-20 -91.85 -77.39 0.43 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 3.86 110.818 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.3 p 45.77 55.31 6.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.077 -0.51 . . . . 1.79 111.271 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.9 t -100.21 9.38 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 1.99 110.972 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.566 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER 56.56 85.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.004 -0.544 . . . . 1.22 111.22 -179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 13.7 m120 -79.89 108.14 8.43 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 1.72 110.739 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 26.2 Cg_exo -60.91 -10.97 16.13 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.306 2.004 . . . . 0.43 112.247 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.575 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.51 -49.91 11.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.132 0.492 . . . . 1.39 109.95 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 68.2 m -77.07 -37.32 54.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.549 -0.75 . . . . 0.71 111.429 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 26' ' ' LEU . 47.9 mt -66.14 -7.66 19.2 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.284 -0.416 . . . . 0.5 111.366 -179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.476 ' HB ' HG12 ' A' ' 81' ' ' ILE . 7.9 p -129.77 18.13 5.7 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.366 -0.533 . . . . 0.35 111.624 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.46 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.5 t70 -110.1 112.91 57.3 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.745 -0.835 . . . . 0.57 108.745 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.545 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.2 Cg_exo -44.03 -20.55 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.663 2.242 . . . . 0.13 113.947 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.532 ' HE3' ' HG2' ' A' ' 21' ' ' MET . 0.1 OUTLIER -60.12 -52.93 63.25 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.391 -0.596 . . . . 1.37 109.391 179.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.668 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -73.91 -47.35 38.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.487 -0.779 . . . . 0.12 110.77 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.8 mt -51.2 -48.46 61.98 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.267 -0.879 . . . . 0.27 111.409 -178.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -69.37 -24.95 63.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.254 0.549 . . . . 0.88 110.03 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 26.6 t30 -114.09 66.64 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.366 -0.834 . . . . 0.53 109.242 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 38' ' ' THR . 19.5 mm -37.45 -49.8 2.56 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.084 -0.507 . . . . 0.49 112.311 -178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.401 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 90.4 Cg_exo -47.89 -52.13 8.71 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 121.31 1.34 . . . . 0.15 110.34 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.598 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -61.33 -41.97 97.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.607 -1.179 . . . . 0.94 109.283 178.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.668 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 73.5 t90 -54.56 -36.58 64.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.649 -0.705 . . . . 0.11 109.46 177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.9 mt -77.23 -26.32 52.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.288 -0.869 . . . . 0.13 110.702 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.757 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.28 -44.25 71.75 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.076 0.465 . . . . 3.29 110.256 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.5 t -76.48 -8.73 57.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.675 -0.693 . . . . 0.96 110.957 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.018 HD21 HD21 ' A' ' 10' ' ' LEU . 66.2 mt -109.77 -0.74 18.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.66 111.071 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.537 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 12.7 mmm180 63.33 21.26 12.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 4.34 111.293 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' ' 65' ' ' LEU . 10.6 mt -114.55 21.66 14.33 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.67 110.526 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.757 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 28.4 p-80 -61.39 -14.32 26.87 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.535 -1.283 . . . . 0.29 107.535 177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.537 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 1.5 ptmt -55.13 -38.32 68.06 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.075 -1.42 . . . . 0.72 108.491 177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.494 ' CG ' HG22 ' A' ' 56' ' ' VAL . 43.5 m-85 -103.16 27.14 7.47 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.073 -1.421 . . . . 0.28 110.496 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 23' ' ' LEU . 94.9 p -63.86 -46.52 84.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.459 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.89 -36.9 84.84 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 120.849 0.357 . . . . 2.21 111.399 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -77.01 -28.02 54.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.15 112.055 -179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.27 -10.98 18.28 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.347 0.499 . . . . 0.47 112.347 -178.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 32' ' ' SER . 31.3 t -66.8 -44.22 81.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.782 0.325 . . . . 0.95 111.049 -179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.93 -11.15 5.54 Favored Glycine 0 C--N 1.332 0.322 0 C-N-CA 120.842 -0.694 . . . . 0.15 112.107 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.618 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.6 m -117.13 127.46 26.69 Favored Pre-proline 0 N--CA 1.452 -0.363 0 N-CA-C 110.584 -0.154 . . . . 0.11 110.584 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.8 Cg_endo -66.86 -179.8 1.86 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.026 2.484 . . . . 0.09 111.759 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.37 -48.53 40.94 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 120.35 -0.54 . . . . 0.21 110.079 179.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.9 OUTLIER -50.01 -26.86 3.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.936 0.398 . . . . 0.45 110.939 -179.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -97.22 -36.59 10.38 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.496 -0.557 . . . . 2.15 109.496 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.578 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -56.83 -58.53 7.74 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.324 -0.853 . . . . 0.11 109.055 178.363 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.628 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.2 pt -57.11 -12.4 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 114.343 -1.299 . . . . 0.2 111.456 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -104.47 -12.73 16.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.289 -0.414 . . . . 0.19 111.512 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.852 HD22 HG21 ' A' ' 50' ' ' THR . 38.2 mt -62.38 -169.19 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.42 0.628 . . . . 0.14 110.985 179.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.573 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.3 m-20 -152.13 167.15 29.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.191 -0.913 . . . . 1.31 109.951 178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.687 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.0 -41.84 26.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.067 0.46 . . . . 1.73 110.166 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -64.09 -52.54 58.77 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.831 -0.622 . . . . 0.52 111.873 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.852 HG21 HD22 ' A' ' 46' ' ' LEU . 89.3 m -56.69 -47.62 79.48 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.19 110.773 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.663 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 45.9 mt -50.91 -41.04 58.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.833 -0.621 . . . . 0.89 110.445 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.629 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.51 -45.05 95.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.566 0.698 . . . . 0.52 109.164 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmpt? -56.94 -33.37 66.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.669 -1.151 . . . . 2.19 111.065 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.67 -57.22 4.14 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.594 0.711 . . . . 1.2 109.831 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.417 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.98 -17.18 0.05 OUTLIER Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 114.679 -1.146 . . . . 0.38 111.379 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 6.6 t -68.64 83.51 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.623 -0.51 . . . . 0.89 109.623 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.417 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.2 OUTLIER -86.14 -18.22 32.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.637 -0.71 . . . . 0.83 112.218 -177.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -70.38 111.1 5.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.477 -0.328 . . . . 0.21 111.667 -179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.461 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.2 mm? -52.32 -28.56 19.71 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.641 -0.874 . . . . 0.27 108.641 177.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.35 -41.31 31.07 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-N 114.713 -1.13 . . . . 0.14 112.611 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.567 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.3 -53.03 10.53 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.346 0.869 . . . . 0.16 113.346 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.65 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.4 ptt180 -63.56 -61.14 2.52 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 112.103 0.409 . . . . 0.81 112.103 -178.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 58.4 mtp180 -50.0 -24.96 2.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.034 0.445 . . . . 2.47 109.911 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 24.2 ttmm -77.67 -40.47 41.48 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.828 -0.624 . . . . 2.52 110.69 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.87 -26.11 61.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.23 110.503 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -62.45 -22.0 65.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.772 -0.649 . . . . 0.15 110.297 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.44 -37.13 44.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.048 -0.723 . . . . 2.2 109.048 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.686 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.88 -31.2 64.54 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.375 -0.829 . . . . 0.23 110.128 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.501 ' HE1' HD12 ' A' ' 43' ' ' LEU . 19.9 m-30 -62.8 -38.9 92.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.634 -0.712 . . . . 0.12 111.621 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.98 -49.15 17.69 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.918 -0.658 . . . . 0.13 113.711 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.5 mt -54.45 -35.23 30.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.949 0.375 . . . . 0.25 110.591 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 68' ' ' ALA . 57.7 t -71.12 -46.2 67.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.051 0.453 . . . . 0.15 110.026 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.52 ' CG1' HD12 ' A' ' 44' ' ' ILE . 41.4 mt -56.87 -57.44 9.62 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.322 0 CA-C-N 115.327 -0.851 . . . . 0.28 111.736 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.95 -55.18 18.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.691 -0.231 . . . . 0.61 111.098 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.567 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.1 m-85 -60.68 -31.33 70.58 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.709 -0.478 . . . . 1.41 109.709 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.641 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.55 -32.8 70.37 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.316 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 21.9 mt-10 -75.75 -27.15 57.98 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.693 -1.139 . . . . 1.16 110.65 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 35.3 mtp180 -92.09 13.07 19.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.814 -0.63 . . . . 2.37 111.157 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.7 t70 57.42 26.0 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 2.13 110.463 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.567 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.23 -16.48 49.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.827 -0.624 . . . . 0.5 110.73 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.641 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.9 mt -101.34 133.98 43.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.847 -0.615 . . . . 0.18 109.828 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -56.92 130.54 46.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.366 -0.379 . . . . 0.47 110.719 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 23.0 mmt85 -59.66 -13.06 8.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 1.48 110.427 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -65.3 -36.46 84.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.924 -0.58 . . . . 1.09 110.035 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.69 -43.72 95.8 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.984 -0.553 . . . . 0.22 110.189 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.7 m-85 . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.206 -0.906 . . . . 1.1 111.216 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 79.7 p . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.82 0.343 . . . . 5.27 110.903 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -164.6 135.67 4.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 3.86 110.837 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.617 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 30.8 t -73.08 84.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.163 -0.471 . . . . 1.79 110.961 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.4 t -136.9 8.54 3.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.99 110.748 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.55 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.2 OUTLIER 58.53 71.01 0.61 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.189 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.5 t-20 -72.3 107.87 3.54 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.04 -0.527 . . . . 1.72 110.682 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.74 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 29.8 Cg_endo -64.95 -10.72 26.45 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.212 1.942 . . . . 0.43 113.08 -178.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.74 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.33 -46.11 18.31 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.34 -0.544 . . . . 1.39 109.614 178.325 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.45 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -77.49 -40.38 43.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.56 -0.746 . . . . 0.71 111.373 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 26' ' ' LEU . 40.9 mt -63.6 -7.13 6.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.5 111.403 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.542 ' HB ' HG12 ' A' ' 81' ' ' ILE . 8.1 p -129.34 17.83 5.95 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.516 -0.473 . . . . 0.35 111.154 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -109.85 112.11 58.33 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 108.673 -0.862 . . . . 0.57 108.673 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.22 -20.3 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.546 2.164 . . . . 0.13 113.813 -178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.57 -51.32 70.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.664 . . . . 1.37 109.209 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -75.96 -47.31 25.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.635 -0.712 . . . . 0.12 110.622 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 10' ' ' LEU . 13.1 mt -51.35 -49.47 61.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.248 -0.887 . . . . 0.27 111.467 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.58 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.4 mttt -67.75 -27.19 66.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.148 0.499 . . . . 0.88 109.828 178.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 21.5 t30 -112.07 67.12 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.451 -0.795 . . . . 0.53 109.218 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -39.28 -49.69 4.64 Favored Pre-proline 0 CA--C 1.531 0.213 0 CA-C-N 116.237 -0.438 . . . . 0.49 111.779 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.426 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.7 Cg_exo -47.17 -44.75 23.22 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 121.595 1.53 . . . . 0.15 110.986 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.44 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -70.64 -42.25 71.11 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.559 -1.201 . . . . 0.94 109.876 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 78.8 t90 -52.34 -37.04 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.497 -0.774 . . . . 0.11 110.208 177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.1 mt -74.07 -28.1 61.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.326 -0.852 . . . . 0.13 111.022 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.25 -40.18 77.1 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.256 -0.429 . . . . 3.29 110.335 179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 62.8 m -74.53 -9.08 58.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.118 -0.492 . . . . 0.96 110.132 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.03 HD21 HD21 ' A' ' 10' ' ' LEU . 47.2 mt -112.64 0.58 15.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.62 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.617 ' HB2' ' HB2' ' A' ' 3' ' ' SER . 22.6 mmt180 66.48 10.74 7.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.714 -0.676 . . . . 4.34 111.819 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -103.94 24.21 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.711 -0.222 . . . . 0.67 111.022 179.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -60.41 -12.76 10.32 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.555 -1.276 . . . . 0.29 107.555 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HE3' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -56.31 -35.36 67.46 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.567 -1.652 . . . . 0.72 108.989 177.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.582 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.3 m-85 -107.16 27.6 8.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.327 -1.306 . . . . 0.28 110.592 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.697 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 m -62.45 -44.79 95.56 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.891 -0.595 . . . . 1.3 110.277 179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.63 -51.23 68.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.056 -0.52 . . . . 2.21 111.248 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.424 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -64.78 -27.36 68.84 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.544 0.572 . . . . 0.15 112.544 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 56' ' ' VAL . 1.5 mp -103.45 -12.67 17.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.437 0.532 . . . . 0.47 112.437 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 32' ' ' SER . 32.3 t -63.2 -45.9 89.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.743 0.306 . . . . 0.95 110.77 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.59 -13.45 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.821 -0.704 . . . . 0.15 112.003 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.575 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.9 m -115.09 124.82 29.69 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 115.973 -0.113 . . . . 0.11 110.701 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.1 Cg_endo -66.22 -179.14 1.32 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.167 2.578 . . . . 0.09 111.893 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.703 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.4 p-90 -72.0 -50.07 31.75 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.545 -0.462 . . . . 0.21 110.002 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.456 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.8 tp -50.98 -23.61 2.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.786 0.326 . . . . 0.45 111.236 -179.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -100.03 -36.37 9.39 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.704 -0.48 . . . . 2.15 109.704 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -57.83 -60.52 3.57 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 121.77 0.795 . . . . 0.11 109.097 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' ' 40' ' ' TRP . 37.7 pt -57.23 -10.42 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.468 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -100.85 -18.03 16.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.116 -0.493 . . . . 0.19 111.186 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 50' ' ' THR . 34.7 mt -63.37 -165.96 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.369 0.605 . . . . 0.14 110.735 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -154.62 174.08 15.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.281 -0.872 . . . . 1.31 110.057 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.578 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 6.6 t70 -48.02 -52.1 21.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.044 -0.526 . . . . 1.73 110.181 178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.18 -51.62 67.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.799 -0.637 . . . . 0.52 111.984 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.87 HG22 ' HD3' ' A' ' 54' ' ' LYS . 68.8 m -59.34 -49.02 79.43 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.794 0.331 . . . . 0.19 111.032 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.611 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 37.8 mt -50.61 -40.57 53.09 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.951 -0.568 . . . . 0.89 110.178 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 23.0 tt0 -61.54 -44.39 97.14 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.705 0.764 . . . . 0.52 109.093 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.424 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.7 mmpt? -59.67 -31.6 69.7 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.529 -1.214 . . . . 2.19 111.909 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.87 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.82 -51.09 14.91 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.551 0.691 . . . . 1.2 109.31 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.42 -15.47 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 114.689 -1.141 . . . . 0.38 111.281 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -71.61 77.04 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.135 0.493 . . . . 0.89 109.88 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.06 -32.87 51.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.526 -0.761 . . . . 0.83 111.918 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.57 109.48 0.56 Allowed 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.384 -0.371 . . . . 0.21 111.642 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD2' HH21 ' A' ' 62' ' ' ARG . 3.3 mm? -51.38 -30.29 18.41 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 108.522 -0.918 . . . . 0.27 108.522 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.41 -38.72 44.51 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.056 -0.975 . . . . 0.14 112.718 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.74 -51.9 12.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.031 0.752 . . . . 0.16 113.031 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 63' ' ' ARG . 26.1 ptt180 -67.67 -62.36 1.45 Allowed 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.157 0.799 . . . . 0.81 113.157 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 66' ' ' LEU . 19.5 ptt180 -50.12 -22.53 1.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.691 -0.485 . . . . 2.47 109.691 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.55 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 24.4 tptm -79.62 -41.66 26.58 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.63 -0.714 . . . . 2.52 110.732 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.61 -25.52 39.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.23 110.526 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.6 mt -57.79 -23.55 52.93 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.865 -0.607 . . . . 0.15 110.174 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.8 mmmm -75.37 -39.77 58.82 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.916 -0.772 . . . . 2.2 108.916 178.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.66 -22.91 61.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.02 -0.991 . . . . 0.23 110.238 179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.531 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.2 m-30 -70.82 -43.56 68.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.619 -0.719 . . . . 0.12 111.7 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -46.54 19.14 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.793 -0.718 . . . . 0.13 114.215 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.2 mt -53.97 -36.3 30.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.937 0.369 . . . . 0.25 110.771 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 64.4 t -71.7 -48.37 52.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.148 -0.478 . . . . 0.15 110.477 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.76 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 38.4 mt -53.04 -50.32 45.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.228 0 CA-C-N 115.555 -0.748 . . . . 0.28 112.203 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -63.82 -58.38 7.01 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.095 -0.502 . . . . 0.61 111.505 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.54 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -55.03 -31.7 61.29 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 109.166 -0.679 . . . . 1.41 109.166 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 10.8 ttmt -64.2 -47.45 79.69 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.319 -0.993 . . . . 1.66 108.319 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.6 mt-10 -69.3 -18.08 63.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.07 -1.423 . . . . 1.16 111.479 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -93.35 17.56 11.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 2.37 110.47 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 52.91 26.25 4.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.022 -0.535 . . . . 2.13 109.986 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.54 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.07 -6.21 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.436 -0.802 . . . . 0.5 110.867 -179.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.586 HD12 ' HB2' ' A' ' 76' ' ' LYS . 55.9 mt -115.2 135.5 54.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.945 -0.57 . . . . 0.18 110.451 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.8 t70 -62.19 135.35 57.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 0.47 110.614 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 25.2 mmt85 -62.33 -13.19 26.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 1.48 110.623 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.5 t -67.1 -35.89 80.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 1.09 110.258 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.591 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.31 -44.07 97.82 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.22 110.042 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.491 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.4 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.088 -0.96 . . . . 1.1 111.28 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.8 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 5.27 110.863 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.518 HD22 ' N ' ' A' ' 2' ' ' ASN . 0.1 OUTLIER -162.78 20.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 3.86 111.074 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.491 ' HB2' ' HG3' ' A' ' 27' ' ' ARG . 24.5 t 61.59 -82.99 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.137 -0.483 . . . . 1.79 110.919 -179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.4 m 61.26 99.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 1.99 111.334 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.524 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -59.02 99.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 1.22 110.26 179.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.632 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 18.8 m120 -84.19 106.17 7.5 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 1.72 111.538 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD2' ' HE2' ' A' ' 8' ' ' LYS . 33.0 Cg_exo -59.42 -16.34 34.75 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 121.944 1.763 . . . . 0.43 111.349 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.632 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -79.41 -63.36 1.43 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.491 -0.777 . . . . 1.39 110.767 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 21.4 t -67.5 -46.81 71.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.222 -0.899 . . . . 0.71 111.844 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 26' ' ' LEU . 77.3 mt -56.54 -13.66 2.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.597 -0.274 . . . . 0.5 111.322 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.571 ' HB ' HG12 ' A' ' 81' ' ' ILE . 15.3 p -123.08 25.32 8.55 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.172 0.51 . . . . 0.35 111.333 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -110.02 113.83 56.65 Favored Pre-proline 0 N--CA 1.451 -0.401 0 N-CA-C 108.472 -0.936 . . . . 0.57 108.472 179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 66.6 Cg_exo -44.41 -20.68 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.58 2.187 . . . . 0.13 114.016 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -51.09 69.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.576 -0.527 . . . . 1.37 109.576 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.69 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -74.93 -45.64 41.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.771 -0.65 . . . . 0.12 110.277 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.744 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.8 mt -50.91 -49.18 60.03 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.075 -0.966 . . . . 0.27 111.465 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.596 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 90.6 mttt -66.67 -26.5 67.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.059 0.457 . . . . 0.88 109.955 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.704 HD22 ' H ' ' A' ' 21' ' ' MET . 1.2 t30 -113.24 67.42 0.66 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.198 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.576 HG13 ' O ' ' A' ' 38' ' ' THR . 19.0 mm -39.0 -50.62 4.14 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 111.936 0.347 . . . . 0.49 111.936 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.29 -46.8 18.85 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 121.712 1.608 . . . . 0.15 111.105 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.704 ' H ' HD22 ' A' ' 18' ' ' ASN . 13.6 tpp -69.95 -40.08 75.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.765 -1.107 . . . . 0.94 109.76 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.69 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 83.4 t90 -54.19 -35.62 62.54 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.812 -0.631 . . . . 0.11 109.556 177.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 32' ' ' SER . 73.4 mt -74.82 -27.78 60.43 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.034 -0.985 . . . . 0.13 110.371 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.82 -38.89 70.62 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.046 0.451 . . . . 3.29 109.839 178.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.3 m -70.54 -16.89 62.93 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 115.81 -0.632 . . . . 0.96 109.895 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.964 HD21 HD21 ' A' ' 10' ' ' LEU . 14.4 mt -112.67 17.31 19.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.487 -0.778 . . . . 0.66 109.78 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HG3' ' HB2' ' A' ' 3' ' ' SER . 0.0 OUTLIER 44.89 19.79 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.295 -0.866 . . . . 4.34 112.128 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 65' ' ' LEU . 16.1 mt -102.78 21.68 15.08 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.064 -0.347 . . . . 0.67 110.064 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -60.12 -12.84 9.4 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 107.331 -1.359 . . . . 0.29 107.331 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -58.23 -41.52 84.29 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.86 -1.518 . . . . 0.72 108.823 177.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.41 ' CG ' HG22 ' A' ' 56' ' ' VAL . 38.9 m-85 -98.89 23.68 8.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.489 -1.232 . . . . 0.28 110.369 179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.627 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.5 p -63.58 -45.56 89.89 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.981 -0.554 . . . . 1.3 110.198 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -60.01 -37.77 80.71 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.038 -0.528 . . . . 2.21 110.798 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.58 -30.46 46.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.628 -0.714 . . . . 0.15 112.498 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.587 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -100.97 -9.05 21.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.521 0.563 . . . . 0.47 112.521 -178.198 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.6 p -66.84 -43.75 82.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.782 0.325 . . . . 0.95 111.107 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -11.38 5.19 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.786 -0.721 . . . . 0.15 112.253 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' HG13 ' A' ' 19' ' ' ILE . 34.4 m -118.69 127.84 26.32 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.093 . . . . 0.11 111.041 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.526 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.6 Cg_endo -67.71 -179.19 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.201 2.601 . . . . 0.09 111.905 179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.0 p-90 -72.08 -49.52 35.7 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.612 -0.435 . . . . 0.21 110.118 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.435 HD12 ' HE2' ' A' ' 76' ' ' LYS . 0.6 OUTLIER -50.86 -23.97 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.45 111.127 -179.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -101.16 -34.66 9.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 2.15 109.817 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.14 -59.49 5.37 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.471 -0.786 . . . . 0.11 109.14 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.9 pt -57.92 -9.54 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 114.327 -1.306 . . . . 0.2 111.299 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.464 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.0 m-30 -104.6 -15.4 15.32 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.156 -0.474 . . . . 0.19 111.345 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 50' ' ' THR . 48.6 mt -62.44 -165.65 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.407 0.623 . . . . 0.14 110.899 179.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.529 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.19 171.47 17.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.229 -0.896 . . . . 1.31 109.848 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.561 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.6 p-10 -48.55 -52.05 24.59 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.03 0.443 . . . . 1.73 110.16 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -52.63 -58.61 6.25 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.645 -0.707 . . . . 0.52 111.028 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.901 HG21 HD22 ' A' ' 46' ' ' LEU . 30.5 m -49.01 -50.59 35.29 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.415 -0.357 . . . . 0.19 111.331 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.655 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.5 mt -50.66 -39.74 51.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.48 . . . . 0.89 110.444 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 21.5 tt0 -66.3 -40.39 89.97 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -62.35 -28.6 69.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.55 -1.204 . . . . 2.19 110.568 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.879 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -77.72 -61.38 2.01 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.603 0.716 . . . . 1.2 109.183 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.433 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 178.84 -17.68 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 114.571 -1.195 . . . . 0.38 111.673 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.642 HG21 HD22 ' A' ' 51' ' ' LEU . 9.6 t -66.52 85.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.261 0.553 . . . . 0.89 110.127 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.433 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -93.1 24.9 3.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.448 -0.797 . . . . 0.83 112.072 -178.03 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -116.53 108.28 15.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.492 -0.322 . . . . 0.21 111.388 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.417 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.1 mm? -49.47 -29.37 6.52 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.789 -0.819 . . . . 0.27 108.789 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.24 -43.3 26.1 Favored Glycine 0 N--CA 1.44 -1.046 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.432 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.655 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.47 -52.22 12.59 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.35 0.87 . . . . 0.16 113.35 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.655 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -64.33 -61.39 2.27 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.356 0.502 . . . . 0.81 112.356 -178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.74 ' HA ' HD12 ' A' ' 66' ' ' LEU . 63.4 mtm180 -50.2 -23.07 1.98 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.057 0.456 . . . . 2.47 110.004 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 22.4 tptp -78.18 -41.79 33.51 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 115.731 -0.668 . . . . 2.52 110.537 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.41 -26.01 51.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.166 -0.47 . . . . 0.23 110.647 179.278 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.8 mt -61.81 -19.84 62.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.856 -0.611 . . . . 0.15 109.916 179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.414 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.9 mmmm -75.27 -41.56 57.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.753 -0.832 . . . . 2.2 108.753 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.668 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -26.52 61.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.956 -1.02 . . . . 0.23 110.254 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.544 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -65.75 -43.89 87.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.773 -0.649 . . . . 0.12 111.544 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.13 -48.49 15.2 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.69 -0.767 . . . . 0.13 114.155 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.0 mt -54.15 -36.02 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.926 0.363 . . . . 0.25 110.965 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 68' ' ' ALA . 91.1 t -70.95 -44.79 75.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.148 0.499 . . . . 0.15 110.07 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 44' ' ' ILE . 35.4 mt -55.29 -42.75 68.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.308 -0.86 . . . . 0.28 111.47 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -63.0 -59.73 4.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.608 -0.724 . . . . 0.61 111.214 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.0 m-30 -55.08 -31.8 61.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.975 -0.75 . . . . 1.41 108.975 178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.57 ' HB2' HD12 ' A' ' 81' ' ' ILE . 5.7 ttmt -66.89 -40.36 87.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.293 -0.867 . . . . 1.66 108.93 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -73.97 -20.78 60.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.44 -1.254 . . . . 1.16 111.302 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.54 9.15 41.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 2.37 110.924 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 19.5 t70 60.3 26.3 15.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.241 0.543 . . . . 2.13 109.912 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.34 -29.28 31.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.588 -0.733 . . . . 0.5 110.47 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.571 HG12 ' HB ' ' A' ' 11' ' ' THR . 86.3 mt -86.4 134.24 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.857 -0.61 . . . . 0.18 110.095 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.52 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.5 t70 -60.29 131.98 52.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.373 -0.376 . . . . 0.47 110.472 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.486 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 9.5 mmt85 -60.2 -13.07 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 1.48 110.705 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 34.2 t -64.43 -36.44 84.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 1.09 109.723 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.458 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.93 -43.32 83.58 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.797 -0.638 . . . . 0.22 110.313 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.6 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.295 -0.859 . . . . 1.1 111.158 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.848 0.356 . . . . 5.27 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.4 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 0.2 OUTLIER -88.91 53.45 2.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 3.86 110.691 -179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.477 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 69.5 p -122.65 80.52 1.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 1.79 110.944 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -121.33 9.76 10.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 1.99 111.129 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.649 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.3 OUTLIER 57.49 85.16 0.09 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.15 -0.477 . . . . 1.22 111.34 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.548 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 16.4 m120 -80.25 106.55 5.28 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.689 -0.232 . . . . 1.72 110.449 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 5' ' ' MET . 35.6 Cg_exo -60.19 -16.52 40.7 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.231 1.954 . . . . 0.43 112.88 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.557 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -78.91 -48.04 15.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.855 0.36 . . . . 1.39 110.712 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.5 m -76.89 -41.42 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.064 -0.517 . . . . 0.71 111.632 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 26' ' ' LEU . 69.7 mt -58.44 -14.94 8.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.508 -0.314 . . . . 0.5 111.242 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.632 HG21 ' HB2' ' A' ' 75' ' ' TYR . 38.2 p -122.7 23.34 9.54 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.654 -0.418 . . . . 0.35 111.763 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 10.5 t70 -109.9 115.05 55.76 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.557 -0.905 . . . . 0.57 108.557 179.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.543 ' HB3' ' HE3' ' A' ' 17' ' ' LYS . 68.9 Cg_exo -44.57 -20.39 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.482 2.122 . . . . 0.13 113.873 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.434 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -48.9 79.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.398 -0.521 . . . . 1.37 109.595 179.601 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.605 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.96 -37.8 38.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.12 110.647 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.728 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -62.68 -33.09 74.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.349 -0.841 . . . . 0.27 111.664 -178.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -83.91 -22.26 31.63 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.792 -0.818 . . . . 0.88 108.792 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.499 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.2 t30 -117.96 65.12 0.75 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.87 -1.059 . . . . 0.53 108.98 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' TRP . 2.9 mm -39.67 -49.78 5.37 Favored Pre-proline 0 C--N 1.332 -0.164 0 N-CA-C 112.673 0.62 . . . . 0.49 112.673 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 95.4 Cg_exo -47.35 -48.68 14.59 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 120.966 1.11 . . . . 0.15 110.184 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -63.25 -39.98 96.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.38 -1.282 . . . . 0.94 109.097 178.391 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.605 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.9 t90 -54.73 -37.0 65.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.668 -0.696 . . . . 0.11 109.441 176.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 81.6 mt -76.68 -26.17 54.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.389 -0.823 . . . . 0.13 110.62 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.76 ' HD3' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -54.35 -45.03 72.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.961 0.41 . . . . 3.29 110.427 178.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.7 m -73.59 -8.37 55.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.826 -0.625 . . . . 0.96 110.624 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.026 HD21 HD21 ' A' ' 10' ' ' LEU . 56.5 mt -111.86 -0.88 15.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.66 110.542 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.477 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 13.6 mmm180 65.29 4.58 2.71 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.845 -0.616 . . . . 4.34 111.392 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.675 HD13 ' HG ' ' A' ' 65' ' ' LEU . 8.7 mt -94.3 21.5 6.94 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 116.394 -0.366 . . . . 0.67 110.836 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 24' ' ' LYS . 33.0 p-80 -60.7 -14.81 23.22 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.492 -1.299 . . . . 0.29 107.492 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.561 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -55.57 -38.6 69.56 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.033 -1.439 . . . . 0.72 108.654 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.0 m-85 -103.02 27.04 7.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.114 -1.403 . . . . 0.28 110.767 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 93.6 p -64.62 -46.74 81.29 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.842 -0.617 . . . . 1.3 110.198 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.29 -38.05 82.41 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.294 -0.412 . . . . 2.21 111.116 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.8 -25.32 44.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.095 -0.502 . . . . 0.15 112.104 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.579 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.28 -6.48 18.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.382 0.512 . . . . 0.47 112.382 -178.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 32' ' ' SER . 47.5 t -72.06 -44.73 62.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.95 111.036 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.35 -11.74 5.33 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.15 112.182 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' HD23 ' A' ' 43' ' ' LEU . 60.1 m -114.14 131.23 23.31 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-O 120.429 0.157 . . . . 0.11 110.924 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 69.2 Cg_endo -70.04 175.75 7.91 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.618 2.212 . . . . 0.09 111.2 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.647 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.9 p-90 -68.31 -49.33 61.12 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 120.219 -0.592 . . . . 0.21 110.083 178.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.25 -27.03 2.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.381 -0.372 . . . . 0.45 111.31 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -98.15 -35.43 10.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.459 -0.571 . . . . 2.15 109.459 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.579 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.54 -60.24 3.82 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.327 -0.851 . . . . 0.11 109.005 178.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.647 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.7 pt -57.51 -14.91 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 114.35 -1.295 . . . . 0.2 111.194 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.422 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.8 m-30 -100.09 -11.65 20.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.514 . . . . 0.19 111.641 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 38.0 mt -64.13 -163.34 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.362 0.601 . . . . 0.14 110.333 179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.45 ' HA ' HD21 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -156.59 171.95 19.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.431 -0.804 . . . . 1.31 110.234 178.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -47.68 -49.51 27.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.824 -0.625 . . . . 1.73 109.779 178.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.1 tt0 -56.46 -61.61 2.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.437 -0.801 . . . . 0.52 111.739 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 86.8 m -47.98 -49.88 29.25 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.456 -0.338 . . . . 0.19 111.589 -178.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.68 HD13 ' HA ' ' A' ' 62' ' ' ARG . 42.4 mt -50.32 -39.93 47.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.89 110.447 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 25.1 tt0 -66.94 -42.2 85.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.693 0.759 . . . . 0.52 109.066 178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -56.9 -31.58 65.03 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.554 -1.203 . . . . 2.19 110.549 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.9 -58.95 2.99 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.561 0.696 . . . . 1.2 109.961 179.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.554 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.03 -14.6 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 114.747 -1.115 . . . . 0.38 111.859 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.3 t -70.3 76.99 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 109.047 -0.723 . . . . 0.89 109.047 178.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.565 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 2.4 mp -84.61 3.03 38.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.334 -0.848 . . . . 0.83 112.512 -177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -90.96 109.99 21.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.581 0.229 . . . . 0.21 111.478 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.4 mm? -50.44 -28.8 8.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.542 -0.91 . . . . 0.27 108.542 178.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -41.48 28.64 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 114.88 -1.055 . . . . 0.14 112.611 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.603 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.02 10.78 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 113.266 0.839 . . . . 0.16 113.266 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HA ' HD13 ' A' ' 51' ' ' LEU . 14.9 ptt180 -65.41 -60.74 2.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 112.624 0.602 . . . . 0.81 112.624 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.704 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtp180 -49.88 -24.64 2.6 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.651 -0.499 . . . . 2.47 109.651 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.649 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 24.3 tptm -79.2 -40.71 30.09 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 115.519 -0.764 . . . . 2.52 110.983 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.675 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.62 -25.31 59.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.23 110.505 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.87 -22.25 65.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.744 -0.662 . . . . 0.15 110.334 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.541 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -78.48 -38.45 40.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.024 -0.732 . . . . 2.2 109.024 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.28 -26.37 61.05 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.223 -0.899 . . . . 0.23 110.445 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.553 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -66.42 -40.31 89.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.65 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.75 -41.9 40.85 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.818 -0.706 . . . . 0.13 113.796 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.542 HD12 ' HA ' ' A' ' 68' ' ' ALA . 22.6 mt -54.29 -38.33 39.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.008 0.432 . . . . 0.25 110.257 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 68' ' ' ALA . 21.8 t -71.67 -49.85 43.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.663 -0.699 . . . . 0.15 110.531 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.76 -42.84 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.212 -0.903 . . . . 0.28 111.515 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.24 -60.7 3.21 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.69 -0.687 . . . . 0.61 111.511 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.632 ' HB2' HG21 ' A' ' 11' ' ' THR . 3.3 m-30 -56.37 -32.4 64.73 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.214 -0.661 . . . . 1.41 109.214 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.562 ' HB2' HD12 ' A' ' 81' ' ' ILE . 4.5 ttmt -64.74 -41.28 96.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.709 -0.848 . . . . 1.66 108.709 177.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -74.36 -17.59 60.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.198 -1.365 . . . . 1.16 111.581 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -101.15 11.67 39.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.342 -0.39 . . . . 2.37 111.588 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.5 t70 59.29 31.09 20.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.185 0.517 . . . . 2.13 110.428 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -89.31 -36.61 15.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.73 -0.668 . . . . 0.5 110.879 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.562 HD12 ' HB2' ' A' ' 76' ' ' LYS . 82.7 mt -78.32 135.28 26.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.332 -0.395 . . . . 0.18 110.247 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.0 t70 -61.36 134.5 57.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.238 -0.437 . . . . 0.47 110.802 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.464 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 22.7 mmt85 -61.63 -13.06 18.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.115 -0.493 . . . . 1.48 110.565 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.7 m -64.1 -36.49 84.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 1.09 109.84 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -66.8 -43.57 83.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.22 110.055 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.208 -0.901 . . . . 1.1 111.253 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.3 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.758 0.313 . . . . 5.27 110.862 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -100.58 119.68 38.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 3.86 110.905 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.512 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 14.1 p -89.3 14.15 11.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 1.79 110.601 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 m -62.4 145.15 54.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 1.99 110.629 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.563 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -86.14 81.8 8.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.077 -0.511 . . . . 1.22 111.199 -179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.9 m120 -65.21 105.75 0.84 Allowed Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 116.464 -0.335 . . . . 1.72 110.836 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.499 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 18.4 Cg_exo -64.56 -12.38 33.26 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.097 1.864 . . . . 0.43 112.43 -179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.612 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.91 -52.01 8.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.016 0.436 . . . . 1.39 110.465 179.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 m -76.8 -37.64 55.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.797 -0.638 . . . . 0.71 111.791 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.768 HD11 HD21 ' A' ' 26' ' ' LEU . 8.0 mt -66.44 -7.44 19.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.5 111.338 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.485 ' HB ' HG12 ' A' ' 81' ' ' ILE . 14.7 p -126.7 20.16 7.19 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.264 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.2 t70 -109.92 114.89 55.88 Favored Pre-proline 0 N--CA 1.451 -0.388 0 N-CA-C 108.52 -0.919 . . . . 0.57 108.52 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.518 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.6 Cg_exo -44.08 -20.41 0.29 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.446 2.097 . . . . 0.13 113.856 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.602 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.06 -56.86 16.8 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.271 -0.64 . . . . 1.37 109.271 179.025 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.6 -43.89 65.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.255 -0.884 . . . . 0.12 110.631 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.704 HD21 ' O ' ' A' ' 10' ' ' LEU . 21.1 mt -54.09 -45.84 71.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.188 -0.914 . . . . 0.27 111.446 -178.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.6 mttt -72.94 -23.78 60.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.193 0.52 . . . . 0.88 109.831 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.452 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -115.52 69.95 0.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.494 -0.776 . . . . 0.53 109.377 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 18.2 mm -42.13 -50.59 11.05 Favored Pre-proline 0 CA--C 1.529 0.169 0 N-CA-C 112.123 0.416 . . . . 0.49 112.123 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.62 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 92.7 Cg_exo -46.25 -43.25 21.47 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.452 1.435 . . . . 0.15 110.79 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.602 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -71.96 -42.38 66.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.45 -1.25 . . . . 0.94 109.59 179.156 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.681 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 74.6 t90 -52.96 -36.57 60.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.79 -0.641 . . . . 0.11 109.981 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 28' ' ' LEU . 82.8 mt -73.8 -27.28 61.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.079 -0.964 . . . . 0.13 110.508 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -55.79 -40.83 73.22 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.204 -0.453 . . . . 3.29 109.851 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 57.8 m -72.12 -14.98 61.98 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.931 -0.577 . . . . 0.96 109.905 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.768 HD21 HD11 ' A' ' 10' ' ' LEU . 30.5 mt -113.83 10.61 17.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.461 -0.79 . . . . 0.66 109.878 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 26' ' ' LEU . 1.1 ppt_? 53.3 0.28 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.652 1.181 . . . . 4.34 114.062 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.612 ' HB2' HD22 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -86.4 25.92 1.14 Allowed 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.536 0.607 . . . . 0.67 110.324 178.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -58.8 -14.54 9.06 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 107.213 -1.403 . . . . 0.29 107.213 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 15.8 pttt -53.48 -44.77 69.26 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 113.877 -1.511 . . . . 0.72 108.093 176.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 35' ' ' LEU . 22.9 m-85 -96.94 34.74 1.66 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.492 -1.686 . . . . 0.28 110.47 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.593 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.0 p -72.28 -45.69 58.98 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.864 -0.607 . . . . 1.3 110.121 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.72 -38.79 86.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.885 -0.598 . . . . 2.21 111.603 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.72 -28.08 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.467 0.543 . . . . 0.15 112.467 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.604 HD11 HG23 ' A' ' 56' ' ' VAL . 1.4 mp -101.74 -13.76 17.61 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.721 0.637 . . . . 0.47 112.721 -177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.62 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.0 t -65.7 -43.71 88.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.861 0.362 . . . . 0.95 110.53 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.6 -19.04 11.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.694 -0.765 . . . . 0.15 111.49 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.7 m -109.02 125.67 31.04 Favored Pre-proline 0 N--CA 1.451 -0.409 0 CA-C-N 115.637 -0.281 . . . . 0.11 110.334 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.52 179.31 2.14 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.903 2.402 . . . . 0.09 111.926 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.655 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.3 p-90 -72.2 -48.93 39.39 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 120.423 -0.511 . . . . 0.21 109.805 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.403 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -49.85 -24.78 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.402 -0.363 . . . . 0.45 110.899 -179.517 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -99.91 -37.82 8.87 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.589 -0.523 . . . . 2.15 109.589 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 38' ' ' THR . 0.2 OUTLIER -55.69 -59.13 5.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.771 0.796 . . . . 0.11 109.06 178.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.2 pt -57.18 -12.26 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 114.324 -1.307 . . . . 0.2 111.316 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.465 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -102.43 -14.57 16.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.19 111.574 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 HG21 ' A' ' 50' ' ' THR . 27.0 mt -63.57 -165.49 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.435 0.636 . . . . 0.14 110.704 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -154.7 175.66 13.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.042 -0.981 . . . . 1.31 109.977 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.49 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -47.89 -53.44 15.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.099 -0.501 . . . . 1.73 110.278 179.19 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.3 tt0 -54.18 -62.4 1.68 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.498 -0.774 . . . . 0.52 112.094 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.839 HG21 HD22 ' A' ' 46' ' ' LEU . 87.8 m -47.58 -47.67 28.41 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.588 -0.278 . . . . 0.19 111.499 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.702 HD13 ' HA ' ' A' ' 62' ' ' ARG . 29.6 mt -51.51 -39.69 58.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.89 110.617 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.529 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 22.1 tt0 -66.78 -40.66 88.25 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.706 0.765 . . . . 0.52 109.141 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -57.89 -33.17 68.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.448 -1.251 . . . . 2.19 111.137 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -76.77 -61.41 1.98 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.474 0.654 . . . . 1.2 109.763 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -178.49 -15.56 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 114.869 -1.059 . . . . 0.38 112.199 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.681 HG21 HD22 ' A' ' 51' ' ' LEU . 11.8 t -66.25 81.12 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.207 0.527 . . . . 0.89 110.175 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -88.92 22.58 2.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.524 -0.762 . . . . 0.83 111.791 -178.458 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -113.87 108.91 17.7 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 116.359 -0.382 . . . . 0.21 111.437 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -51.05 -28.82 11.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.64 -0.874 . . . . 0.27 108.64 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.51 -41.69 29.26 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 114.79 -1.095 . . . . 0.14 112.532 178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.98 -52.66 12.09 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 113.283 0.846 . . . . 0.16 113.283 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.702 ' HA ' HD13 ' A' ' 51' ' ' LEU . 12.5 ptt180 -64.81 -60.64 2.85 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 112.597 0.592 . . . . 0.81 112.597 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 78.8 mtp180 -49.57 -24.65 2.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.543 -0.539 . . . . 2.47 109.543 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.563 ' HG3' ' HE1' ' A' ' 5' ' ' MET . 29.1 tptp -79.59 -42.85 24.11 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.551 -0.75 . . . . 2.52 111.041 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -55.36 -24.59 30.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.23 110.661 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.02 -21.84 63.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.9 -0.591 . . . . 0.15 110.036 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE3' ' HB3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -75.63 -38.93 58.55 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.93 -0.577 . . . . 2.2 109.629 178.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -36.59 68.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.06 -0.973 . . . . 0.23 110.257 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.535 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.0 m-30 -56.67 -41.37 77.16 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.625 -0.716 . . . . 0.12 111.63 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.71 -51.75 9.04 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.824 -0.703 . . . . 0.13 113.939 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -54.09 -34.77 27.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 117.005 0.402 . . . . 0.25 110.775 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 68' ' ' ALA . 82.6 t -71.37 -45.59 68.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.987 0.423 . . . . 0.15 109.991 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.555 ' CG1' HD12 ' A' ' 44' ' ' ILE . 44.1 mt -57.47 -55.49 20.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.269 0 CA-C-N 115.484 -0.78 . . . . 0.28 111.316 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.1 -56.34 13.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.363 -0.38 . . . . 0.61 111.086 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.581 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.6 m-85 -60.42 -31.39 70.35 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.073 0.463 . . . . 1.41 109.829 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.623 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -70.29 -33.28 71.36 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.545 -0.909 . . . . 1.66 108.545 177.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 73' ' ' ILE . 17.2 mt-10 -76.14 -27.31 56.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.553 -1.203 . . . . 1.16 110.912 179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -92.22 13.44 19.12 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.77 -0.65 . . . . 2.37 111.165 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t70 58.2 22.63 9.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.031 -0.531 . . . . 2.13 110.582 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -81.75 -6.02 58.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.917 -0.583 . . . . 0.5 110.6 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.623 HD12 ' HB2' ' A' ' 76' ' ' LYS . 77.5 mt -112.45 132.02 62.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.665 -0.698 . . . . 0.18 109.902 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.5 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.9 t70 -56.91 133.92 55.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.165 -0.47 . . . . 0.47 110.875 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.7 mmt85 -61.6 -12.78 17.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 1.48 110.173 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.6 m -64.75 -37.44 87.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.858 -0.61 . . . . 1.09 109.975 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.518 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.19 -41.76 97.37 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.114 -0.494 . . . . 0.22 109.992 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 6.8 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.272 -0.87 . . . . 1.1 111.086 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.874 0.369 . . . . 5.27 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -103.2 99.31 9.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 3.86 110.763 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.48 ' HB3' ' NE ' ' A' ' 27' ' ' ARG . 93.2 p -94.66 27.48 3.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.283 -0.417 . . . . 1.79 111.314 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -60.81 122.47 14.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.696 0.284 . . . . 1.99 110.676 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.621 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -71.79 78.68 0.86 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 1.22 111.008 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.52 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -66.73 107.68 1.83 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.222 -0.444 . . . . 1.72 110.713 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.517 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 21.9 Cg_exo -63.27 -11.12 23.87 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.042 1.828 . . . . 0.43 112.032 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.549 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.7 -51.25 9.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.073 0.464 . . . . 1.39 110.282 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 50.5 m -76.78 -39.2 52.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.667 -0.697 . . . . 0.71 111.543 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 26' ' ' LEU . 67.1 mt -64.32 -8.95 14.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.491 -0.322 . . . . 0.5 110.857 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.508 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.5 p -127.89 18.78 6.65 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.492 -0.483 . . . . 0.35 111.262 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.0 t70 -109.88 111.94 58.37 Favored Pre-proline 0 N--CA 1.451 -0.383 0 N-CA-C 108.699 -0.852 . . . . 0.57 108.699 178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.533 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.5 Cg_exo -43.62 -20.02 0.21 Allowed 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.415 2.076 . . . . 0.13 113.59 -178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.486 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.5 OUTLIER -57.41 -56.77 17.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.895 -0.78 . . . . 1.37 108.895 178.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.72 -47.01 56.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.159 -0.928 . . . . 0.12 110.467 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.4 mt -50.69 -45.63 58.35 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.056 -0.974 . . . . 0.27 111.384 -179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.438 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.5 mttt -73.33 -27.25 61.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.945 0.403 . . . . 0.88 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -111.78 67.83 0.66 Allowed 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 108.749 -0.834 . . . . 0.53 108.749 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 38' ' ' THR . 21.2 mm -38.93 -49.57 4.05 Favored Pre-proline 0 CA--C 1.529 0.146 0 CA-C-N 116.016 -0.538 . . . . 0.49 111.995 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 81.0 Cg_exo -46.9 -46.06 19.36 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.616 1.544 . . . . 0.15 110.946 178.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.486 ' HG2' ' NZ ' ' A' ' 14' ' ' LYS . 9.2 tpp -70.27 -41.95 72.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.761 -1.109 . . . . 0.94 109.511 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.63 -36.54 56.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.723 -0.672 . . . . 0.11 109.607 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.0 mt -76.73 -27.65 55.51 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.035 -0.984 . . . . 0.13 110.457 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.81 -44.08 77.53 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.181 -0.463 . . . . 3.29 110.131 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.8 m -70.22 -11.09 60.65 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.96 109.999 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.961 HD21 HD21 ' A' ' 10' ' ' LEU . 18.2 mt -116.54 14.5 15.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.343 -0.844 . . . . 0.66 109.85 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.521 HH11 ' HG ' ' A' ' 28' ' ' LEU . 1.3 ppt_? 47.19 14.25 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.115 -0.948 . . . . 4.34 112.781 -179.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 65' ' ' LEU . 1.3 mt -97.07 19.58 12.66 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 110.13 -0.322 . . . . 0.67 110.13 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -60.64 -14.4 20.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 107.176 -1.416 . . . . 0.29 107.176 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 7.9 pttt -58.48 -34.56 71.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.368 -1.742 . . . . 0.72 108.848 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.47 ' CG ' HG22 ' A' ' 56' ' ' VAL . 36.5 m-85 -105.76 20.89 18.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.973 -1.467 . . . . 0.28 110.35 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.6 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.1 t -59.8 -46.7 88.4 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.839 -0.619 . . . . 1.3 110.266 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.97 -40.26 80.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.032 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.11 -25.23 47.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.619 -0.719 . . . . 0.15 112.484 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.64 -6.98 16.59 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.58 0.585 . . . . 0.47 112.58 -178.095 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 32' ' ' SER . 39.0 t -68.97 -47.38 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.696 0.284 . . . . 0.95 111.106 -178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.3 -14.31 4.52 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.685 -0.769 . . . . 0.15 112.04 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.572 ' O ' HG13 ' A' ' 19' ' ' ILE . 26.7 m -112.81 126.52 28.16 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-N 116.016 -0.092 . . . . 0.11 110.832 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.501 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.9 Cg_endo -67.0 179.41 2.31 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.958 2.439 . . . . 0.09 111.578 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.623 ' O ' HG12 ' A' ' 44' ' ' ILE . 47.3 p-90 -71.68 -47.78 51.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.479 -0.488 . . . . 0.21 110.066 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.454 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.04 -26.97 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.411 -0.359 . . . . 0.45 111.032 -179.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -98.55 -34.6 10.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.227 0.537 . . . . 2.15 109.639 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -59.18 -58.55 8.13 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.335 -0.848 . . . . 0.11 109.036 178.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.651 HG21 HG11 ' A' ' 72' ' ' VAL . 23.2 pt -58.73 -6.09 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 114.501 -1.227 . . . . 0.2 111.371 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.432 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.1 m-30 -108.58 -14.72 14.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.311 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.849 HD22 HG21 ' A' ' 50' ' ' THR . 41.9 mt -63.2 -168.08 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.104 0.478 . . . . 0.14 110.522 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -150.53 167.25 27.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 1.31 110.368 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.579 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -48.19 -34.65 10.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.299 0.571 . . . . 1.73 110.047 179.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -68.75 -62.14 1.51 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.322 -0.854 . . . . 0.52 111.369 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.849 HG21 HD22 ' A' ' 46' ' ' LEU . 51.7 m -48.68 -44.55 37.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.709 0.29 . . . . 0.19 110.946 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.64 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 48.2 mt -51.02 -42.24 60.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.902 -0.59 . . . . 0.89 110.128 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 31.6 tt0 -59.25 -50.62 73.32 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 108.877 -0.786 . . . . 0.52 108.877 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.517 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 0.3 OUTLIER -52.21 -31.18 30.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.259 -1.337 . . . . 2.19 111.942 179.706 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.2 mmmt -77.47 -57.52 3.78 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.64 0.733 . . . . 1.2 109.853 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.58 -16.72 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.691 0 CA-C-N 114.635 -1.166 . . . . 0.38 111.548 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.64 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 8.7 t -68.59 87.3 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.049 0.452 . . . . 0.89 109.874 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.0 13.13 28.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.686 -0.688 . . . . 0.83 112.346 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -102.87 109.48 21.07 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.592 -0.276 . . . . 0.21 111.496 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.7 mm? -50.93 -27.78 8.31 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.575 -0.898 . . . . 0.27 108.575 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.629 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.12 -42.65 28.54 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.794 -1.094 . . . . 0.14 112.124 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -75.11 -55.26 5.92 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.241 0.83 . . . . 0.16 113.241 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.64 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.6 ptt180 -63.07 -62.01 2.0 Allowed 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.781 0.66 . . . . 0.81 112.781 -177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 66' ' ' LEU . 54.2 mtp180 -49.69 -23.18 1.62 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.012 0.434 . . . . 2.47 109.945 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.629 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 26.3 tptp -79.09 -41.28 29.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.781 -0.645 . . . . 2.52 110.581 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.587 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.23 -25.5 47.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.233 -0.439 . . . . 0.23 110.524 179.373 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.49 -22.3 64.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.844 -0.616 . . . . 0.15 110.307 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 9.6 mmmm -74.47 -39.92 62.2 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.953 -0.758 . . . . 2.2 108.953 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.739 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.04 -31.98 66.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.0 -1.0 . . . . 0.23 110.289 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.506 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -61.69 -41.99 98.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.819 -0.628 . . . . 0.12 111.716 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.38 -49.89 10.98 Favored Glycine 0 N--CA 1.453 -0.169 0 C-N-CA 120.854 -0.688 . . . . 0.13 114.249 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.2 mt -53.98 -34.62 26.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.879 0.34 . . . . 0.25 111.026 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 68' ' ' ALA . 58.4 t -71.02 -44.19 75.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.131 0.491 . . . . 0.15 110.3 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.56 HG13 HD12 ' A' ' 44' ' ' ILE . 45.2 mt -57.92 -55.84 19.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.297 -0.865 . . . . 0.28 112.231 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.71 -55.82 27.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.44 -0.345 . . . . 0.61 111.209 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB3' ' A' ' 7' ' ' PRO . 15.9 m-85 -57.43 -32.55 67.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.993 -0.373 . . . . 1.41 109.993 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.595 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -62.19 -47.04 86.23 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.858 -1.164 . . . . 1.66 107.858 176.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.06 -20.68 65.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 113.541 -1.663 . . . . 1.16 111.381 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -89.51 9.42 26.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.196 -0.456 . . . . 2.37 110.962 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.4 t70 59.69 23.4 12.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.368 0.604 . . . . 2.13 109.537 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -25.1 29.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.358 -0.837 . . . . 0.5 110.378 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HB2' ' A' ' 76' ' ' LYS . 67.9 mt -95.1 133.28 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 115.73 -0.668 . . . . 0.18 110.355 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.506 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -60.08 134.08 56.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.92 -0.582 . . . . 0.47 110.553 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -61.92 -13.24 23.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.035 0.445 . . . . 1.48 110.003 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.2 m -64.92 -30.83 71.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.858 -0.61 . . . . 1.09 110.054 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.533 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.44 -43.62 66.36 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.136 -0.484 . . . . 0.22 109.826 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.436 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-N 115.131 -0.941 . . . . 1.1 111.296 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.835 0.35 . . . . 5.27 110.825 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.447 HD22 ' H ' ' A' ' 5' ' ' MET . 3.9 p-10 -121.69 172.45 8.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 3.86 110.996 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 73.5 m -94.43 48.46 1.23 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 1.79 111.054 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.7 m 55.91 56.49 5.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.081 -0.509 . . . . 1.99 111.513 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG2' ' HE3' ' A' ' 67' ' ' LYS . 0.5 OUTLIER -73.33 98.04 2.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.399 -0.364 . . . . 1.22 110.241 179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.471 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -96.88 103.05 13.42 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.388 -0.369 . . . . 1.72 111.148 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 5' ' ' MET . 39.9 Cg_exo -56.7 -13.95 12.25 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.223 1.949 . . . . 0.43 112.377 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.81 -54.45 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.854 0.359 . . . . 1.39 110.73 179.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.5 m -75.26 -41.73 56.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.71 111.228 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 26' ' ' LEU . 72.3 mt -59.39 -12.34 5.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.414 . . . . 0.5 111.189 179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.613 ' HB ' HG12 ' A' ' 81' ' ' ILE . 21.1 p -124.62 23.03 8.18 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.029 0.443 . . . . 0.35 111.397 -179.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 12.8 t70 -110.31 114.12 55.77 Favored Pre-proline 0 N--CA 1.451 -0.376 0 N-CA-C 108.539 -0.911 . . . . 0.57 108.539 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.645 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 69.7 Cg_exo -44.13 -19.8 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.547 2.165 . . . . 0.13 113.861 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.446 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -61.01 -55.1 36.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.211 -0.663 . . . . 1.37 109.211 179.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.642 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.35 -44.47 62.57 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.604 -0.725 . . . . 0.12 110.221 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 26.0 mt -52.46 -50.53 62.47 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.036 -0.984 . . . . 0.27 111.62 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 41.9 mttm -67.03 -23.24 65.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.995 0.426 . . . . 0.88 110.171 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -118.5 69.66 0.8 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.743 -0.662 . . . . 0.53 109.566 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 38' ' ' THR . 19.3 mm -40.78 -48.6 7.38 Favored Pre-proline 0 CA--C 1.529 0.165 0 CA-C-N 116.388 -0.369 . . . . 0.49 111.915 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 96.6 Cg_exo -47.02 -45.15 21.79 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.711 1.607 . . . . 0.15 111.006 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.416 ' C ' HD12 ' A' ' 15' ' ' LEU . 10.5 tpp -71.31 -41.88 69.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.726 -1.125 . . . . 0.94 109.568 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.642 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 72.9 t90 -52.72 -37.46 59.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.11 110.009 177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.5 mt -76.34 -27.71 56.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.339 -0.846 . . . . 0.13 110.289 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -56.99 -38.53 73.18 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.069 -0.514 . . . . 3.29 109.893 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.9 m -76.61 -12.26 59.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.96 110.199 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.099 HD21 HD21 ' A' ' 10' ' ' LEU . 57.3 mt -109.17 2.22 20.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.773 -0.649 . . . . 0.66 110.912 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 13.3 mmm180 67.4 11.54 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.774 -0.648 . . . . 4.34 111.678 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -104.41 22.46 14.86 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.786 -0.188 . . . . 0.67 111.1 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -60.5 -13.17 12.28 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 107.154 -1.425 . . . . 0.29 107.154 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.452 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.1 pttt -60.21 -36.98 78.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 113.348 -1.751 . . . . 0.72 109.038 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 37.4 m-85 -104.71 22.0 15.88 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.438 -1.255 . . . . 0.28 110.372 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.659 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -61.38 -46.03 91.88 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 115.894 -0.593 . . . . 1.3 110.211 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -59.07 -39.48 82.26 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.057 -0.52 . . . . 2.21 111.023 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.45 -25.57 45.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.803 -0.635 . . . . 0.15 112.664 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -105.83 -7.8 18.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.431 0.53 . . . . 0.47 112.431 -178.357 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.441 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 41.7 t -67.4 -46.63 72.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.95 111.316 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.59 -14.89 3.91 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.797 -0.716 . . . . 0.15 112.297 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.638 ' O ' HG13 ' A' ' 19' ' ' ILE . 39.8 m -111.45 129.55 23.98 Favored Pre-proline 0 N--CA 1.453 -0.282 0 CA-C-N 116.043 -0.079 . . . . 0.11 110.832 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 66.7 Cg_endo -69.41 -179.12 2.54 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.936 2.424 . . . . 0.09 111.809 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.657 ' O ' HG12 ' A' ' 44' ' ' ILE . 41.6 p-90 -72.27 -49.6 33.6 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 120.504 -0.478 . . . . 0.21 110.244 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.419 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.3 tp -51.07 -24.65 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.791 0.329 . . . . 0.45 110.94 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -98.63 -36.57 9.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.56 -0.534 . . . . 2.15 109.56 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.512 HD12 ' HE1' ' A' ' 69' ' ' PHE . 0.2 OUTLIER -57.66 -57.36 13.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.744 -0.835 . . . . 0.11 108.744 178.221 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 40' ' ' TRP . 34.0 pt -60.03 -6.8 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 114.261 -1.336 . . . . 0.2 111.136 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -108.03 -14.27 14.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.971 -0.558 . . . . 0.19 111.215 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.908 HD22 HG21 ' A' ' 50' ' ' THR . 59.3 mt -63.59 -168.24 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.389 0.614 . . . . 0.14 110.833 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.555 ' O ' HD13 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.6 163.65 39.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.201 -0.909 . . . . 1.31 109.721 178.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.662 ' H ' HD11 ' A' ' 66' ' ' LEU . 4.0 p-10 -44.94 -47.86 11.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.946 0.403 . . . . 1.73 110.559 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -55.76 -49.03 74.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.834 -0.621 . . . . 0.52 111.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.908 HG21 HD22 ' A' ' 46' ' ' LEU . 99.7 m -61.03 -51.93 67.13 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.754 0.311 . . . . 0.19 110.897 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.759 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 10.0 mp -49.56 -39.69 35.79 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.974 -0.557 . . . . 0.89 110.494 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 24.1 tt0 -62.03 -42.66 99.41 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.926 -0.768 . . . . 0.52 108.926 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.427 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -60.25 -35.72 76.15 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.674 -1.148 . . . . 2.19 111.078 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.8 mmmt -71.37 -54.87 9.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.562 0.696 . . . . 1.2 109.689 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 169.32 -16.03 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.712 -1.131 . . . . 0.38 111.621 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.759 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.4 t -70.57 80.74 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 109.391 -0.596 . . . . 0.89 109.391 178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.34 -31.45 33.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.558 -0.746 . . . . 0.83 112.273 -177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -55.19 110.62 0.71 Allowed 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 116.488 -0.323 . . . . 0.21 111.816 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.2 mm? -53.32 -29.07 31.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.496 -0.928 . . . . 0.27 108.496 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.99 -41.78 26.61 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 114.886 -1.052 . . . . 0.14 112.805 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.1 -49.15 30.06 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 113.235 0.828 . . . . 0.16 113.235 -178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.49 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 15.0 ptt180 -69.21 -59.05 3.27 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 112.584 0.587 . . . . 0.81 112.584 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.79 ' HA ' HD12 ' A' ' 66' ' ' LEU . 46.0 mtp180 -50.72 -24.4 3.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.829 0.347 . . . . 2.47 110.377 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -77.41 -43.06 33.89 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 2.52 111.293 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -56.53 -26.23 54.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.23 110.543 179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.79 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -58.12 -24.04 57.26 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.829 -0.623 . . . . 0.15 110.299 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.477 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 20.1 ttpp -77.81 -40.69 39.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 108.929 -0.767 . . . . 2.2 108.929 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.7 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.32 -22.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.889 -1.051 . . . . 0.23 109.955 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.9 m-30 -71.39 -43.6 66.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.738 -0.665 . . . . 0.12 111.728 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.05 -47.22 19.42 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.669 -0.777 . . . . 0.13 113.856 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 18.2 mt -53.97 -35.08 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.863 0.363 . . . . 0.25 110.924 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.7 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.7 t -70.83 -46.85 66.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.185 0.516 . . . . 0.15 110.624 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.648 ' CG1' HD12 ' A' ' 44' ' ' ILE . 64.0 mt -53.54 -55.04 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.274 -0.875 . . . . 0.28 111.612 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -50.67 -52.14 42.74 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.357 -0.383 . . . . 0.61 111.652 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.566 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.6 m-30 -60.73 -35.47 76.42 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.66 -0.416 . . . . 1.41 110.208 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.9 OUTLIER -61.9 -49.73 75.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.669 1.223 . . . . 1.66 108.409 177.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 64.6 mt-10 -71.22 -15.8 62.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 112.554 -2.112 . . . . 1.16 112.112 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -97.97 12.39 34.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 2.37 110.544 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.6 t70 62.24 19.24 10.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.09 -0.504 . . . . 2.13 110.275 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -83.12 -34.94 25.97 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.996 -0.547 . . . . 0.5 110.356 179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.613 HG12 ' HB ' ' A' ' 11' ' ' THR . 64.5 mt -84.83 133.86 28.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.918 -0.583 . . . . 0.18 110.072 178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 3.2 t70 -58.17 131.16 49.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.229 -0.441 . . . . 0.47 110.373 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 24.1 mmt85 -59.77 -13.04 8.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.178 -0.464 . . . . 1.48 110.358 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.1 t -66.18 -34.31 77.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.028 -0.533 . . . . 1.09 110.378 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.645 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -63.26 -39.98 96.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.22 109.887 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.467 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.047 -0.979 . . . . 1.1 111.336 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.2 m . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.791 0.329 . . . . 5.27 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.77 -169.2 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 3.86 110.919 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.58 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 4.1 p 56.26 27.69 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.139 -0.482 . . . . 1.79 110.59 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.3 m -85.3 16.22 3.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.945 -0.57 . . . . 1.99 111.451 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.483 ' HE3' ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER 58.61 78.01 0.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.325 -0.398 . . . . 1.22 110.92 -179.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.503 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 23.7 m120 -75.79 109.69 8.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.225 -0.443 . . . . 1.72 111.465 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' HD2' ' NZ ' ' A' ' 8' ' ' LYS . 26.1 Cg_exo -62.4 -8.15 12.07 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.241 1.96 . . . . 0.43 111.356 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.522 ' NZ ' ' HD2' ' A' ' 7' ' ' PRO . 3.2 mppt? -79.05 -55.02 5.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.814 -0.63 . . . . 1.39 110.529 179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.429 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 1.2 m -76.52 -37.02 57.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.6 -0.727 . . . . 0.71 111.477 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 26' ' ' LEU . 66.3 mt -65.04 -9.56 23.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.362 -0.381 . . . . 0.5 111.294 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 75' ' ' TYR . 14.4 p -128.36 17.66 6.5 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.337 -0.545 . . . . 0.35 111.686 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -110.09 114.45 55.92 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 108.569 -0.9 . . . . 0.57 108.569 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.511 ' HG2' ' HB3' ' A' ' 82' ' ' ASP . 71.6 Cg_exo -44.66 -20.09 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.602 2.201 . . . . 0.13 113.962 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.43 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.26 -51.82 67.94 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.25 -0.648 . . . . 1.37 109.25 179.227 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.93 -47.13 31.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.668 -0.696 . . . . 0.12 110.368 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.3 mt -50.83 -50.44 56.54 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.234 -0.894 . . . . 0.27 111.336 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -65.57 -26.69 67.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.043 0.449 . . . . 0.88 110.297 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -115.78 70.19 0.75 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.702 -0.681 . . . . 0.53 109.396 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.584 HG13 ' O ' ' A' ' 38' ' ' THR . 18.6 mm -39.94 -49.12 5.89 Favored Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 116.325 -0.398 . . . . 0.49 111.838 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.3 Cg_exo -46.79 -45.65 19.89 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.647 1.565 . . . . 0.15 111.323 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 8.2 tpp -71.47 -40.56 70.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.873 -1.058 . . . . 0.94 109.65 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.698 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 81.5 t90 -52.61 -35.97 55.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.526 -0.761 . . . . 0.11 109.863 177.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 32' ' ' SER . 78.7 mt -76.5 -27.58 56.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.173 -0.921 . . . . 0.13 110.905 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -55.71 -39.88 71.66 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 120.933 0.397 . . . . 3.29 110.616 179.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.2 t -74.32 -14.12 60.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.96 110.262 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.046 HD21 HD21 ' A' ' 10' ' ' LEU . 40.5 mt -107.16 5.31 27.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.715 -0.675 . . . . 0.66 110.535 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 15.8 mmm180 60.41 15.49 5.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.64 . . . . 4.34 111.128 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.66 HD13 ' HG ' ' A' ' 65' ' ' LEU . 6.3 mt -107.35 23.72 13.99 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.387 -0.369 . . . . 0.67 110.92 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.464 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 30.6 p-80 -61.16 -13.05 15.01 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 107.366 -1.346 . . . . 0.29 107.366 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.631 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.85 -35.78 71.42 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 113.862 -1.517 . . . . 0.72 109.362 177.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.6 ' CD2' HG13 ' A' ' 56' ' ' VAL . 34.0 m-85 -104.41 21.65 16.29 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.685 -1.143 . . . . 0.28 110.559 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.735 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.7 m -58.86 -42.64 89.88 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.017 -0.538 . . . . 1.3 109.99 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.01 -39.73 93.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.924 -0.58 . . . . 2.21 111.359 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB1' ' HB3' ' A' ' 54' ' ' LYS . . . -78.96 -20.87 48.14 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.246 0.462 . . . . 0.15 112.246 -179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.666 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -107.32 -12.32 15.37 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.118 0.414 . . . . 0.47 112.118 -178.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 32' ' ' SER . 45.0 t -65.74 -44.09 87.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.762 0.315 . . . . 0.95 110.88 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.85 -12.92 5.68 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.773 -0.727 . . . . 0.15 112.197 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.584 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.8 m -117.09 126.73 27.22 Favored Pre-proline 0 N--CA 1.453 -0.316 0 N-CA-C 110.737 -0.097 . . . . 0.11 110.737 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 59.2 Cg_endo -66.93 179.57 2.2 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.868 2.378 . . . . 0.09 111.641 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.628 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.9 p-90 -72.34 -47.9 46.07 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 120.402 -0.519 . . . . 0.21 110.218 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.515 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.91 -26.65 4.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.45 110.825 -179.512 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -96.75 -37.88 10.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.292 -0.633 . . . . 2.15 109.292 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.666 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -55.25 -60.37 3.5 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.282 -0.872 . . . . 0.11 108.944 178.382 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.662 HG21 HG11 ' A' ' 72' ' ' VAL . 15.0 pt -56.13 -11.75 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.289 -1.323 . . . . 0.2 111.509 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.8 m-30 -106.82 -11.42 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.19 111.616 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.815 HD22 HG21 ' A' ' 50' ' ' THR . 37.1 mt -64.19 -165.64 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.363 0.601 . . . . 0.14 110.929 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.522 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.4 m-20 -152.74 170.33 20.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.184 -0.917 . . . . 1.31 109.545 178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.8 p-10 -48.31 -48.2 36.18 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.156 0.503 . . . . 1.73 109.936 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.538 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.4 tt0 -53.43 -64.04 0.95 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 0.52 111.177 179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.815 HG21 HD22 ' A' ' 46' ' ' LEU . 86.6 m -48.04 -45.46 32.16 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.421 -0.354 . . . . 0.19 111.377 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.623 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.4 mt -54.96 -40.56 70.11 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.782 -0.451 . . . . 0.89 109.782 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 20.3 tt0 -64.29 -41.87 96.66 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.629 -0.878 . . . . 0.52 108.629 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.7 mmmm -59.7 -33.63 71.85 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.424 -1.262 . . . . 2.19 110.021 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.6 ' HG3' HD12 ' A' ' 35' ' ' LEU . 5.8 mmtt -68.14 -56.44 8.8 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 122.16 0.981 . . . . 1.2 109.506 178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 162.81 -14.79 0.12 Allowed Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 113.473 -1.694 . . . . 0.38 109.961 -178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.6 t -68.8 77.86 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 114.791 -0.705 . . . . 0.89 109.292 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD13 ' O ' ' A' ' 55' ' ' GLY . 0.3 OUTLIER -79.2 -31.78 43.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.492 -0.777 . . . . 0.83 112.362 -177.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.6 110.27 0.61 Allowed 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.131 0.419 . . . . 0.21 112.131 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 63' ' ' ARG . 4.3 mm? -53.28 -28.23 26.89 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.566 -0.901 . . . . 0.27 108.566 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.52 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.31 -40.45 33.55 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.805 -1.089 . . . . 0.14 112.527 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.578 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.49 -53.99 8.42 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 113.312 0.856 . . . . 0.16 113.312 -179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.608 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.8 ptt180 -65.26 -61.25 2.24 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 112.628 0.603 . . . . 0.81 112.628 -177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.727 ' HA ' HD12 ' A' ' 66' ' ' LEU . 50.6 mtp180 -50.2 -24.57 2.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.145 0.498 . . . . 2.47 109.731 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 59.0 tttp -79.08 -39.25 34.26 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.61 -0.723 . . . . 2.52 110.788 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.66 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -57.48 -24.97 58.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.001 0.429 . . . . 0.23 110.4 179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.2 mt -62.8 -19.21 63.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.745 -0.661 . . . . 0.15 109.987 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 11.0 mmmm -77.07 -39.35 50.11 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.028 -0.73 . . . . 2.2 109.028 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.766 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -70.64 -35.69 73.04 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.155 -0.93 . . . . 0.23 110.124 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.2 m-30 -58.08 -42.92 86.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.12 111.507 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.54 -50.18 21.6 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.844 -0.693 . . . . 0.13 114.097 -178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.6 mt -53.76 -35.56 27.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 117.092 0.446 . . . . 0.25 110.434 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' ALA . 46.5 t -71.11 -48.42 55.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 0.15 110.054 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.491 ' CG1' HD12 ' A' ' 44' ' ' ILE . 32.8 mt -53.33 -42.66 48.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.165 -0.925 . . . . 0.28 112.178 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -62.67 -61.32 2.5 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.28 -0.418 . . . . 0.61 111.317 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.527 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.1 m-30 -55.52 -31.44 62.08 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.808 -0.812 . . . . 1.41 108.808 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.1 tttm -67.02 -39.62 87.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.045 -0.98 . . . . 1.66 108.946 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.31 -22.62 59.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.529 -1.214 . . . . 1.16 111.029 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 78' ' ' ARG . 51.7 mtt180 -96.41 16.68 17.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 2.37 110.874 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 51.25 28.05 3.94 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.021 -0.536 . . . . 2.13 110.767 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.12 -30.02 31.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.817 -0.629 . . . . 0.5 110.361 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.545 HD12 ' HB2' ' A' ' 76' ' ' LYS . 83.7 mt -83.5 134.07 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.953 -0.567 . . . . 0.18 109.942 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.6 t70 -57.98 131.48 50.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.378 . . . . 0.47 110.469 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.9 mmt85 -60.21 -12.94 10.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.051 -0.522 . . . . 1.48 110.49 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 70.9 m -62.47 -39.18 92.61 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.592 -0.521 . . . . 1.09 109.592 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.432 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -64.09 -42.84 96.77 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.796 -0.638 . . . . 0.22 110.174 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.2 m-85 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.292 -0.861 . . . . 1.1 111.123 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.766 0.317 . . . . 5.27 110.885 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -119.61 28.54 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 3.86 110.662 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -88.76 41.7 1.04 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 1.79 110.717 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 t -80.18 141.87 35.26 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.084 -0.507 . . . . 1.99 111.242 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.491 ' HG3' ' HB2' ' A' ' 68' ' ' ALA . 0.0 OUTLIER -84.19 82.36 8.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.864 -0.607 . . . . 1.22 110.783 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.513 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.3 m120 -70.26 109.11 4.27 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.357 -0.383 . . . . 1.72 111.461 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.28 -14.7 35.72 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.325 2.016 . . . . 0.43 112.396 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.447 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -79.14 -50.1 11.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.914 0.388 . . . . 1.39 110.487 179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -76.69 -40.92 47.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.71 111.592 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 26' ' ' LEU . 75.6 mt -64.26 -8.25 12.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.349 -0.387 . . . . 0.5 111.239 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.551 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.5 p -128.06 20.8 6.36 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.307 -0.557 . . . . 0.35 111.587 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.543 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 27.3 t70 -110.01 114.32 56.23 Favored Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 108.372 -0.973 . . . . 0.57 108.372 178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 58.6 Cg_exo -43.51 -20.1 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.537 2.158 . . . . 0.13 113.764 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.537 ' HE2' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -59.58 -56.66 19.13 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 178.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -71.69 -44.88 63.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.513 -0.767 . . . . 0.12 110.57 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.582 HD21 ' O ' ' A' ' 10' ' ' LEU . 11.9 mt -53.09 -50.73 63.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.514 -0.766 . . . . 0.27 111.011 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.02 -24.35 65.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.053 0.454 . . . . 0.88 109.932 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 22.7 t30 -113.69 64.83 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.129 -0.693 . . . . 0.53 109.129 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.67 -50.72 2.8 Favored Pre-proline 0 N--CA 1.463 0.195 0 CA-C-N 116.077 -0.511 . . . . 0.49 112.055 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.466 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.7 Cg_exo -46.95 -48.57 14.13 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 121.549 1.499 . . . . 0.15 110.781 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.537 ' HG2' ' HE2' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -65.4 -43.55 90.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.625 -1.17 . . . . 0.94 109.394 178.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.603 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.6 t90 -52.57 -36.97 57.03 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.505 -0.77 . . . . 0.11 109.936 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 32' ' ' SER . 75.8 mt -76.69 -26.65 54.98 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.31 -0.859 . . . . 0.13 111.093 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -62.96 -38.76 92.39 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 109.824 -0.436 . . . . 3.29 109.824 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -73.66 -6.47 46.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.291 0.567 . . . . 0.96 109.576 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.076 HD21 HD21 ' A' ' 10' ' ' LEU . 45.0 mt -116.95 1.36 12.62 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.376 -0.829 . . . . 0.66 110.569 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 66.48 7.95 5.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.727 -0.67 . . . . 4.34 111.825 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.6 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -99.33 20.83 12.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.812 -0.177 . . . . 0.67 111.231 179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -61.3 -12.2 12.74 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 107.112 -1.44 . . . . 0.29 107.112 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' HA ' ' A' ' 28' ' ' LEU . 4.3 pttt -59.8 -35.81 75.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.493 -1.685 . . . . 0.72 108.828 177.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.615 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.5 m-85 -104.49 21.65 16.34 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.28 -1.327 . . . . 0.28 110.171 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.639 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.2 t -59.16 -46.15 89.13 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.788 -0.642 . . . . 1.3 110.299 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -59.46 -40.15 85.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.996 -0.547 . . . . 2.21 111.157 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.65 -22.68 46.51 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.616 0.599 . . . . 0.15 112.616 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -108.41 -8.95 15.49 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.544 0.572 . . . . 0.47 112.544 -178.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' SER . 33.6 t -67.76 -42.54 81.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.859 0.362 . . . . 0.95 110.956 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.99 -9.3 7.05 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.774 -0.727 . . . . 0.15 112.223 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.579 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.2 m -119.11 126.58 26.98 Favored Pre-proline 0 N--CA 1.453 -0.291 0 CA-C-O 120.279 0.085 . . . . 0.11 110.847 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.503 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.3 Cg_endo -66.82 -179.35 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.279 2.652 . . . . 0.09 111.996 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.634 ' O ' HG12 ' A' ' 44' ' ' ILE . 44.4 p-90 -72.19 -48.82 40.28 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 120.607 -0.437 . . . . 0.21 110.026 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.53 -27.78 3.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.824 0.345 . . . . 0.45 111.043 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -97.31 -36.62 10.34 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.526 -0.546 . . . . 2.15 109.526 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -56.54 -57.92 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.808 0.813 . . . . 0.11 108.847 178.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.634 HG12 ' O ' ' A' ' 40' ' ' TRP . 21.0 pt -57.42 -13.26 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 114.21 -1.359 . . . . 0.2 111.483 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.453 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -103.87 -11.19 17.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.635 -179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 50' ' ' THR . 46.9 mt -63.05 -165.64 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.14 110.871 179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.479 ' HA ' HD21 ' A' ' 66' ' ' LEU . 9.8 m-20 -154.7 170.62 21.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.07 -0.968 . . . . 1.31 109.752 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.471 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -50.07 -40.27 44.83 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.475 0.655 . . . . 1.73 109.893 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.8 tt0 -62.12 -58.82 6.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.888 -1.051 . . . . 0.52 111.489 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.938 HG21 HD22 ' A' ' 46' ' ' LEU . 91.2 m -50.73 -48.13 59.06 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.618 0.247 . . . . 0.19 111.049 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 65.1 mt -50.35 -41.31 51.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.886 -0.597 . . . . 0.89 110.251 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.502 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 29.1 tt0 -62.02 -47.34 85.18 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 122.031 0.919 . . . . 0.52 108.699 177.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.2 mmmm -54.28 -31.43 53.77 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.4 -1.727 . . . . 2.19 110.907 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.62 ' NZ ' HD13 ' A' ' 46' ' ' LEU . 1.3 mmmm -77.92 -55.07 5.6 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.649 0.738 . . . . 1.2 109.968 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 168.1 -16.53 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 114.487 -1.233 . . . . 0.38 111.114 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.6 t -70.02 89.35 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.583 -0.525 . . . . 0.89 109.583 178.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.56 -28.0 18.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.949 -0.569 . . . . 0.83 112.383 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -58.1 110.04 0.86 Allowed 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.067 0.395 . . . . 0.21 112.067 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 3.9 mm? -53.3 -27.95 25.67 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.605 -0.887 . . . . 0.27 108.605 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.519 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -74.89 -41.48 33.24 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.197 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.86 -55.36 5.88 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 113.096 0.776 . . . . 0.16 113.096 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 32.9 ptt180 -63.16 -62.42 1.71 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.718 0.636 . . . . 0.81 112.718 -177.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.754 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.9 mtp180 -49.9 -23.3 1.87 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.823 -0.436 . . . . 2.47 109.823 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 56.4 tptt -79.06 -40.32 31.58 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 115.817 -0.629 . . . . 2.52 110.84 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.6 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.04 -24.65 40.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.073 0.463 . . . . 0.23 110.395 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.754 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.5 mt -63.18 -18.38 63.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.567 -0.742 . . . . 0.15 110.351 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 2.6 mtpt -76.4 -39.22 54.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.461 0.648 . . . . 2.2 109.381 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.6 -39.25 67.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 114.973 -1.012 . . . . 0.23 110.339 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.509 ' HE1' HD12 ' A' ' 43' ' ' LEU . 18.6 m-30 -54.51 -40.94 69.08 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.12 111.991 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.46 -51.21 10.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.668 -0.777 . . . . 0.13 113.889 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.0 mt -54.36 -34.73 28.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.735 0.302 . . . . 0.25 110.849 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 68' ' ' ALA . 51.9 t -71.05 -45.52 71.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.166 0.508 . . . . 0.15 110.18 179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.543 ' CG1' HD12 ' A' ' 44' ' ' ILE . 37.9 mt -56.2 -49.95 73.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.261 -0.882 . . . . 0.28 111.521 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.24 -60.36 3.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.265 -0.425 . . . . 0.61 111.427 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.5 m-30 -56.75 -32.46 65.61 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.048 0.452 . . . . 1.41 109.832 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.637 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -68.74 -36.2 78.08 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.685 -0.857 . . . . 1.66 108.685 177.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.56 -23.46 56.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.77 -1.105 . . . . 1.16 110.866 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -98.6 24.09 7.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.815 -0.629 . . . . 2.37 111.031 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p30 44.68 29.02 0.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.619 . . . . 2.13 111.398 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -82.73 -30.48 29.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.904 -0.589 . . . . 0.5 110.448 179.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.637 HD12 ' HB2' ' A' ' 76' ' ' LYS . 88.6 mt -86.36 137.56 20.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.18 110.15 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.49 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.7 t70 -58.31 129.93 44.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.446 -0.343 . . . . 0.47 110.236 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.517 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 29.6 mmm-85 -60.48 -12.78 10.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 1.48 110.732 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.1 m -67.75 -36.78 81.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.097 -0.501 . . . . 1.09 110.245 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.573 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.72 -46.6 89.78 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.22 110.163 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.547 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-N 115.094 -0.957 . . . . 1.1 111.341 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.849 0.357 . . . . 5.27 110.879 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -82.14 175.71 10.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 3.86 110.789 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.1 m -78.1 1.42 21.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 1.79 110.292 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 p 75.17 -49.15 0.64 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.411 -0.813 . . . . 1.99 111.94 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.61 ' HE1' ' H ' ' A' ' 68' ' ' ALA . 0.0 OUTLIER 65.98 -75.09 0.05 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.634 0.254 . . . . 1.22 110.747 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.436 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 0.3 OUTLIER 72.04 91.04 0.07 OUTLIER Pre-proline 0 N--CA 1.464 0.232 0 N-CA-C 112.406 0.521 . . . . 1.72 112.406 178.237 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.737 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 18.0 Cg_endo -58.96 -6.35 3.47 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.127 2.551 . . . . 0.43 111.905 179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.2 -51.28 9.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.355 -0.609 . . . . 1.39 109.355 178.191 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 23.4 m -76.93 -33.45 57.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.093 -0.958 . . . . 0.71 110.765 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.663 ' HB3' HG22 ' A' ' 72' ' ' VAL . 22.2 mt -63.65 -10.65 19.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.5 111.113 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.515 HG23 ' O ' ' A' ' 7' ' ' PRO . 3.6 p -128.22 19.17 6.44 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.567 -0.453 . . . . 0.35 111.684 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 36.3 t70 -109.74 110.92 59.24 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.037 -0.727 . . . . 0.57 109.037 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.492 ' HA ' HD12 ' A' ' 16' ' ' LEU . 60.6 Cg_exo -44.28 -20.79 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.741 2.294 . . . . 0.13 113.814 -178.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.28 -50.78 72.29 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.282 -0.636 . . . . 1.37 109.282 179.265 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.693 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -76.07 -48.28 21.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.412 -0.813 . . . . 0.12 110.655 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.542 HD21 ' O ' ' A' ' 10' ' ' LEU . 12.0 mt -50.42 -47.74 56.45 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.228 -0.897 . . . . 0.27 111.445 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -69.79 -26.29 64.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.131 0.491 . . . . 0.88 110.078 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.496 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 25.1 t30 -112.89 67.13 0.66 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.53 109.209 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 21.6 mm -38.63 -50.73 3.76 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-N 116.248 -0.433 . . . . 0.49 112.144 -178.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.443 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 98.7 Cg_exo -47.25 -46.35 19.84 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 121.544 1.496 . . . . 0.15 110.9 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.68 -43.25 76.53 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.635 -1.166 . . . . 0.94 109.542 178.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.693 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -52.22 -36.74 53.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.49 -0.777 . . . . 0.11 109.72 177.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -74.67 -32.14 62.13 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.308 -0.86 . . . . 0.13 110.271 178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.56 -35.35 65.63 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.093 -0.503 . . . . 3.29 109.835 179.03 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -72.86 -22.4 60.78 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.96 110.001 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.706 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -104.51 5.85 34.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.918 -0.583 . . . . 0.66 110.552 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 15.4 mmm180 66.01 11.75 7.97 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.068 -0.515 . . . . 4.34 112.087 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 26' ' ' LEU . 1.0 OUTLIER -101.93 24.21 10.33 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 111.423 0.157 . . . . 0.67 111.423 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 -60.03 -13.46 11.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.393 -1.336 . . . . 0.29 107.393 177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.1 ptmt -57.73 -42.0 82.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.974 -1.467 . . . . 0.72 109.061 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.585 ' CD2' HG13 ' A' ' 56' ' ' VAL . 36.1 m-85 -100.26 24.58 8.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.499 -1.228 . . . . 0.28 110.602 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 96.2 p -62.58 -45.06 94.65 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.783 -0.644 . . . . 1.3 110.163 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -62.26 -38.01 87.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.97 -0.559 . . . . 2.21 111.391 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -24.3 44.28 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.258 0.466 . . . . 0.15 112.258 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.24 -10.0 16.61 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.349 0.5 . . . . 0.47 112.349 -178.461 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.437 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 40.4 t -66.08 -43.42 87.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.689 0.28 . . . . 0.95 111.187 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.35 -10.23 5.37 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.761 -0.733 . . . . 0.15 112.196 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 20.0 m -119.05 127.37 26.55 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.049 -0.076 . . . . 0.11 110.899 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -67.09 -179.44 1.77 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.17 2.58 . . . . 0.09 112.028 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.658 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.8 p-90 -72.43 -48.59 40.0 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.566 -0.453 . . . . 0.21 110.014 178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -50.36 -24.19 2.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.852 0.358 . . . . 0.45 111.005 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -101.29 -36.06 9.03 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.069 -0.514 . . . . 2.15 109.879 179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -57.19 -57.59 11.95 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.81 0.814 . . . . 0.11 109.04 178.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 40' ' ' TRP . 25.8 pt -59.72 -6.34 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 114.205 -1.361 . . . . 0.2 111.313 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.42 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -107.25 -14.72 14.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.19 111.013 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 50' ' ' THR . 35.1 mt -63.17 -168.74 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.2 0.524 . . . . 0.14 110.695 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.629 ' O ' HD13 ' A' ' 51' ' ' LEU . 12.3 m-20 -155.31 168.13 28.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.489 -0.778 . . . . 1.31 110.255 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.613 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -44.62 -44.01 8.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.184 -0.462 . . . . 1.73 110.371 -179.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.8 tt0 -59.09 -61.17 2.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.086 -0.506 . . . . 0.52 111.244 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.941 HG21 HD22 ' A' ' 46' ' ' LEU . 92.3 m -48.06 -54.14 14.08 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 112.113 0.412 . . . . 0.19 112.113 -178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.661 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.7 mp -49.18 -38.32 25.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.416 -0.356 . . . . 0.89 111.057 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.576 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -65.88 -42.19 90.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.883 0.849 . . . . 0.52 108.818 178.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 5.2 mmmm -59.33 -31.48 69.21 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.063 -1.426 . . . . 2.19 110.936 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.4 mmmt -77.69 -60.16 2.48 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.421 0.629 . . . . 1.2 110.184 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.526 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.37 -13.61 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 114.857 -1.065 . . . . 0.38 112.0 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.661 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 3.7 t -69.77 76.88 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.896 -0.779 . . . . 0.89 108.896 178.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 55' ' ' GLY . 2.7 mp -86.21 16.97 3.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.214 -0.903 . . . . 0.83 112.736 -177.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -105.95 110.29 22.51 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.534 0.207 . . . . 0.21 111.459 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 4.5 mm? -50.39 -29.48 10.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.49 -0.93 . . . . 0.27 108.49 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.98 -41.31 27.97 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 114.875 -1.057 . . . . 0.14 112.569 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.673 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.72 -52.5 11.39 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.382 0.882 . . . . 0.16 113.382 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 15.2 ptt180 -67.31 -60.56 2.49 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 113.139 0.792 . . . . 0.81 113.139 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.731 ' HA ' HD12 ' A' ' 66' ' ' LEU . 95.0 mtt180 -49.57 -23.04 1.46 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.039 0.447 . . . . 2.47 110.084 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.7 mptt -79.02 -46.12 18.81 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.655 -0.702 . . . . 2.52 111.455 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -55.3 -24.66 29.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.486 -0.324 . . . . 0.23 110.879 -179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.731 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.5 mt -57.21 -20.47 27.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.417 -0.586 . . . . 0.15 109.417 178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HB2' ' CE ' ' A' ' 5' ' ' MET . 17.0 mmmt -77.43 -41.27 40.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.011 -0.737 . . . . 2.2 109.011 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.723 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.75 -28.12 65.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.26 -0.882 . . . . 0.23 109.979 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.554 ' CE2' HD11 ' A' ' 51' ' ' LEU . 16.4 m-30 -66.23 -43.07 87.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.641 -0.708 . . . . 0.12 111.067 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.34 -46.57 19.99 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.625 -0.798 . . . . 0.13 113.214 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.6 mt -54.56 -38.44 42.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.769 0.319 . . . . 0.25 110.646 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.1 t -70.81 -43.52 77.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.145 0.498 . . . . 0.15 110.38 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.48 ' CG1' HD12 ' A' ' 44' ' ' ILE . 33.7 mt -56.48 -58.01 7.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.481 -0.782 . . . . 0.28 111.513 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.1 t70 -51.83 -54.01 33.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.142 -0.481 . . . . 0.61 111.248 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.563 ' CD1' HD22 ' A' ' 80' ' ' LEU . 17.2 m-85 -60.21 -32.16 70.84 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 110.037 -0.357 . . . . 1.41 110.037 179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.686 ' HB2' HD12 ' A' ' 81' ' ' ILE . 3.9 ttmt -68.48 -34.67 76.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.237 -1.023 . . . . 1.66 108.237 177.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 2.8 mm-40 -74.46 -25.49 59.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.499 -1.228 . . . . 1.16 110.958 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -91.58 10.21 28.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.516 . . . . 2.37 110.912 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t70 59.63 23.85 12.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.205 0.526 . . . . 2.13 109.867 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.563 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -80.26 -20.8 43.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.5 110.469 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.686 HD12 ' HB2' ' A' ' 76' ' ' LYS . 97.8 mt -97.06 130.89 45.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.736 -0.666 . . . . 0.18 109.7 178.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.481 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 2.8 t70 -57.88 132.43 53.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.353 -0.385 . . . . 0.47 110.66 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 21.6 mmt85 -60.01 -13.18 10.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 1.48 110.301 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 t -63.1 -37.35 86.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.89 -0.596 . . . . 1.09 109.857 179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' CB ' ' A' ' 13' ' ' PRO . . . -66.24 -41.27 90.25 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.735 -0.666 . . . . 0.22 110.37 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.468 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.6 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.242 -0.885 . . . . 1.1 111.073 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.653 0.263 . . . . 5.27 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 60.54 63.63 1.32 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.144 -0.48 . . . . 3.86 111.012 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -92.67 7.33 43.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 1.79 110.216 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.8 t -63.41 154.21 32.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.709 -0.678 . . . . 1.99 111.308 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.564 ' HE1' ' HG3' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -77.85 103.72 7.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.823 -0.626 . . . . 1.22 110.479 179.527 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.4 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 21.7 t-20 -90.97 109.54 35.76 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.617 -0.265 . . . . 1.72 111.133 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' A' ' 5' ' ' MET . 28.8 Cg_exo -58.86 -22.41 62.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.845 2.364 . . . . 0.43 113.257 -179.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.34 -45.77 18.96 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.839 -0.344 . . . . 1.39 110.985 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.417 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 32.3 t -77.29 -49.71 14.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.173 -0.467 . . . . 0.71 111.547 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 26' ' ' LEU . 73.6 mt -56.53 -13.37 2.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.191 -0.458 . . . . 0.5 111.442 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.547 ' HB ' HG12 ' A' ' 81' ' ' ILE . 10.7 p -123.77 22.83 8.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.145 0.498 . . . . 0.35 111.403 -178.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 10.3 t70 -110.16 115.3 54.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 108.468 -0.938 . . . . 0.57 108.468 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.583 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.8 Cg_exo -44.27 -20.1 0.28 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.383 2.055 . . . . 0.13 113.695 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.6 -50.04 75.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.299 -0.63 . . . . 1.37 109.299 179.185 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.1 mm? -78.92 -39.26 35.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.486 -0.779 . . . . 0.12 110.741 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.713 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.2 mt -61.58 -34.31 75.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.229 -0.896 . . . . 0.27 111.881 -178.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.6 mttm -80.84 -25.19 37.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.028 -0.73 . . . . 0.88 109.028 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -117.64 68.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.121 -0.945 . . . . 0.53 108.79 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.1 mm -41.79 -48.74 10.46 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.914 -0.585 . . . . 0.49 112.257 -178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.452 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 82.1 Cg_exo -46.68 -43.05 23.73 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.288 1.325 . . . . 0.15 110.79 178.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.468 ' C ' HD12 ' A' ' 15' ' ' LEU . 11.7 tpp -71.6 -39.52 70.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.628 -1.169 . . . . 0.94 109.52 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.7 t90 -53.13 -38.4 62.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.832 -0.622 . . . . 0.11 109.585 177.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 28' ' ' LEU . 81.3 mt -74.84 -26.57 59.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.241 -0.891 . . . . 0.13 110.405 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.75 -43.47 76.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.244 -0.434 . . . . 3.29 110.296 179.392 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.4 m -71.14 -8.66 54.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.273 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.975 HD21 HD21 ' A' ' 10' ' ' LEU . 41.4 mt -113.96 0.4 14.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.546 -0.752 . . . . 0.66 110.091 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 62.92 13.03 6.28 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.644 -0.707 . . . . 4.34 111.002 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.672 HD23 ' HE2' ' A' ' 30' ' ' LYS . 9.8 mt -100.64 19.38 17.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.226 -0.443 . . . . 0.67 110.732 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.2 p-80 -62.38 -11.77 17.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 106.681 -1.6 . . . . 0.29 106.681 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.672 ' HE2' HD23 ' A' ' 28' ' ' LEU . 0.5 OUTLIER -61.76 -34.24 75.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 113.346 -1.752 . . . . 0.72 108.224 177.418 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.57 ' CD2' HG13 ' A' ' 56' ' ' VAL . 24.7 m-85 -103.91 23.49 12.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.026 -1.443 . . . . 0.28 109.836 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 36' ' ' SER . 12.5 t -62.47 -50.72 70.34 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.737 -0.665 . . . . 1.3 110.491 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.32 -38.41 65.94 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 120.891 0.377 . . . . 2.21 111.076 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.6 -27.6 41.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.969 -0.559 . . . . 0.15 112.391 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.2 -2.02 22.95 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.554 0.575 . . . . 0.47 112.554 -178.285 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 32' ' ' SER . 95.3 p -75.55 -45.98 34.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.861 0.362 . . . . 0.95 110.731 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.03 -11.42 6.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.708 -0.758 . . . . 0.15 111.829 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.476 ' O ' HD23 ' A' ' 43' ' ' LEU . 21.8 m -113.59 126.75 27.68 Favored Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 120.377 0.132 . . . . 0.11 110.682 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.2 Cg_endo -68.25 175.85 6.27 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.663 2.242 . . . . 0.09 111.357 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.639 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.5 p-90 -69.39 -47.73 63.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.082 -0.647 . . . . 0.21 109.833 178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.3 OUTLIER -49.48 -27.0 2.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.45 111.003 -179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -97.94 -36.87 10.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.197 0.522 . . . . 2.15 109.654 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -55.76 -59.49 4.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.222 -0.899 . . . . 0.11 109.081 178.473 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.639 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.8 pt -56.66 -14.1 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 114.371 -1.286 . . . . 0.2 111.224 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.6 m-30 -100.53 -14.76 18.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.19 111.538 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 50' ' ' THR . 34.4 mt -63.12 -166.51 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.475 0.655 . . . . 0.14 110.801 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.467 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.1 m-20 -152.62 172.53 16.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.962 -1.017 . . . . 1.31 109.277 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 2.1 p-10 -48.42 -52.17 23.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 121.027 0.442 . . . . 1.73 110.138 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.54 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 34.5 tt0 -51.91 -62.22 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.594 -0.73 . . . . 0.52 111.515 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.898 HG21 HD22 ' A' ' 46' ' ' LEU . 89.8 m -47.27 -50.8 20.64 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.498 -0.319 . . . . 0.19 111.269 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.669 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.2 mt -50.71 -41.57 56.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.89 110.283 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 20.2 tt0 -64.16 -40.9 97.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.617 0.722 . . . . 0.52 109.102 178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.8 mmmm -60.16 -34.33 73.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.649 -1.16 . . . . 2.19 110.905 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.9 mmmt -73.53 -55.61 6.1 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.524 0.678 . . . . 1.2 109.575 179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.73 -16.93 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 114.641 -1.163 . . . . 0.38 111.556 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 5.1 t -69.13 78.06 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.123 0.487 . . . . 0.89 109.844 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.4 OUTLIER -79.33 -23.69 43.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.555 -0.748 . . . . 0.83 112.022 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.89 109.36 1.43 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.958 0.355 . . . . 0.21 111.958 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.476 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.74 -28.58 22.75 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.564 -0.902 . . . . 0.27 108.564 177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.566 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.57 -39.48 34.89 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-N 114.867 -1.061 . . . . 0.14 112.515 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.58 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.21 -53.99 8.65 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.997 0.74 . . . . 0.16 112.997 -179.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.667 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.6 ptt180 -64.67 -60.73 2.78 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 112.674 0.62 . . . . 0.81 112.674 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.735 ' HA ' HD12 ' A' ' 66' ' ' LEU . 93.0 mtt180 -50.11 -24.8 2.95 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.634 -0.506 . . . . 2.47 109.634 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.566 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 14.2 tppt? -79.1 -41.17 29.28 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.505 -0.77 . . . . 2.52 110.811 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -57.23 -25.1 58.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.23 110.385 179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.28 -22.3 64.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.841 -0.618 . . . . 0.15 109.991 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -78.13 -39.14 42.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.025 -0.732 . . . . 2.2 109.025 178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.72 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.34 -23.58 61.17 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.095 -0.957 . . . . 0.23 110.218 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.534 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.3 m-30 -70.81 -40.82 72.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.018 -0.537 . . . . 0.12 111.288 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.76 -47.86 18.94 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.899 -0.667 . . . . 0.13 113.913 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.4 mt -54.22 -36.27 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 117.051 0.426 . . . . 0.25 110.439 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.72 HG23 ' O ' ' A' ' 68' ' ' ALA . 59.5 t -71.24 -47.85 57.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.958 -0.565 . . . . 0.15 110.159 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.529 ' CG1' HD12 ' A' ' 44' ' ' ILE . 34.9 mt -54.84 -54.24 25.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.34 -0.845 . . . . 0.28 111.476 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.467 ' O ' ' HG2' ' A' ' 78' ' ' ARG . 23.2 t70 -50.62 -58.12 6.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.296 -0.411 . . . . 0.61 111.412 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.691 ' HA ' ' HG2' ' A' ' 78' ' ' ARG . 3.6 m-30 -56.73 -42.11 78.69 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.268 -0.641 . . . . 1.41 109.268 179.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.613 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -56.55 -37.75 70.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.443 -0.947 . . . . 1.66 108.443 177.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 16.8 mt-10 -75.67 -28.97 58.91 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.49 -1.232 . . . . 1.16 111.793 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.691 ' HG2' ' HA ' ' A' ' 75' ' ' TYR . 12.6 ptp180 -102.32 40.47 1.34 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.982 0.896 . . . . 2.37 111.619 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 36.45 36.56 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 113.339 -1.755 . . . . 2.13 112.654 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -92.03 -25.03 19.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.747 0.308 . . . . 0.5 110.72 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.613 HD12 ' HB2' ' A' ' 76' ' ' LYS . 80.1 mt -93.89 133.78 33.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.311 -0.404 . . . . 0.18 110.431 178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.6 t70 -59.31 133.15 55.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.122 -0.49 . . . . 0.47 110.572 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 16.2 mmt85 -61.41 -12.79 15.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.165 -0.47 . . . . 1.48 110.542 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 74.6 m -66.55 -36.97 83.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 1.09 110.178 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.583 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.08 -43.39 95.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.086 0.47 . . . . 0.22 109.964 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.461 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 5.0 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.104 -0.953 . . . . 1.1 111.151 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.701 0.286 . . . . 5.27 110.857 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 56.57 -158.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.263 -0.426 . . . . 3.86 110.967 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 35.7 p 48.64 54.39 10.69 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.276 -0.42 . . . . 1.79 110.972 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 m -113.0 12.53 19.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.957 -0.565 . . . . 1.99 110.987 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.478 ' HA ' HD11 ' A' ' 10' ' ' LEU . 0.5 OUTLIER 58.04 59.71 3.0 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.979 -0.555 . . . . 1.22 111.265 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.607 ' HB3' ' HG2' ' A' ' 8' ' ' LYS . 16.0 m120 -55.52 105.64 0.56 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 1.72 111.347 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 20.9 Cg_exo -62.87 -12.07 27.43 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.13 1.886 . . . . 0.43 111.492 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.607 ' HG2' ' HB3' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -78.99 -61.15 2.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.61 -0.723 . . . . 1.39 110.446 178.435 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.445 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.1 m -69.6 -39.38 77.28 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.01 -0.996 . . . . 0.71 112.088 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 26' ' ' LEU . 48.2 mt -62.14 -12.37 19.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.662 0.267 . . . . 0.5 111.103 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.556 ' HB ' HG12 ' A' ' 81' ' ' ILE . 11.6 p -122.59 20.46 10.28 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.439 -0.505 . . . . 0.35 111.327 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -109.98 112.59 57.76 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.044 -0.724 . . . . 0.57 109.044 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.59 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 68.2 Cg_exo -44.3 -20.24 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.527 2.151 . . . . 0.13 113.578 -178.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.443 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -60.81 -53.94 51.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.053 -0.721 . . . . 1.37 109.053 179.26 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -72.74 -46.3 54.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.63 -0.714 . . . . 0.12 110.16 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.726 HD21 ' O ' ' A' ' 10' ' ' LEU . 23.4 mt -50.1 -51.1 45.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.102 -0.954 . . . . 0.27 111.639 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.54 -22.43 63.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.06 0.457 . . . . 0.88 110.161 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.7 t30 -113.99 64.81 0.66 Allowed 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.92 -0.77 . . . . 0.53 108.92 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' O ' ' A' ' 38' ' ' THR . 23.0 mm -37.4 -51.02 2.54 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-N 116.08 -0.509 . . . . 0.49 112.235 -178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.463 ' HB3' ' HB2' ' A' ' 32' ' ' SER . 97.6 Cg_exo -47.24 -47.59 16.89 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 121.553 1.502 . . . . 0.15 110.672 178.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.574 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.22 -44.23 84.43 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.346 -1.297 . . . . 0.94 109.473 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.676 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 75.5 t90 -53.3 -35.98 60.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.377 -0.828 . . . . 0.11 109.865 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.685 HD12 ' HA ' ' A' ' 32' ' ' SER . 91.1 mt -76.85 -25.59 53.31 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.081 -0.963 . . . . 0.13 110.755 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.83 -36.31 80.8 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 120.928 0.394 . . . . 3.29 110.337 179.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -75.63 -8.92 58.01 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.9 -0.591 . . . . 0.96 109.647 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.878 HD21 HD21 ' A' ' 10' ' ' LEU . 53.8 mt -114.56 -4.14 12.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.358 -0.837 . . . . 0.66 110.308 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.593 ' HB2' ' HB3' ' A' ' 3' ' ' SER . 8.4 mmm180 72.59 0.27 3.56 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.652 -0.704 . . . . 4.34 111.466 -179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.796 HD11 ' HB1' ' A' ' 61' ' ' ALA . 4.0 mm? -86.85 18.29 3.57 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 121.032 -0.267 . . . . 0.67 111.021 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -59.98 -13.31 10.67 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.457 -1.312 . . . . 0.29 107.457 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 5.5 ptpt -58.35 -35.83 72.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.727 -1.578 . . . . 0.72 108.776 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.616 ' CD2' HG13 ' A' ' 56' ' ' VAL . 48.8 m-85 -107.4 26.17 10.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.206 -1.361 . . . . 0.28 110.122 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.685 ' HA ' HD12 ' A' ' 23' ' ' LEU . 88.4 p -61.92 -46.12 90.74 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.774 -0.648 . . . . 1.3 110.49 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -61.72 -35.7 78.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.102 -0.499 . . . . 2.21 111.111 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.09 -29.64 49.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.905 -0.589 . . . . 0.15 112.558 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -102.01 -12.97 17.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.332 0.493 . . . . 0.47 112.332 -178.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.452 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 48.4 t -63.37 -43.45 97.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.722 0.296 . . . . 0.95 110.813 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.27 -14.03 11.41 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.735 -0.745 . . . . 0.15 112.019 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.631 ' O ' HG13 ' A' ' 19' ' ' ILE . 25.0 m -115.59 127.35 26.86 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 110.492 -0.188 . . . . 0.11 110.492 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.0 Cg_endo -66.69 179.5 2.13 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.995 2.463 . . . . 0.09 111.949 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 44' ' ' ILE . 46.4 p-90 -72.19 -48.17 45.22 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.599 -0.44 . . . . 0.21 110.115 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.458 HD12 ' NZ ' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -50.02 -27.59 3.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 0.45 110.994 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -96.86 -36.26 10.65 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.433 -0.58 . . . . 2.15 109.433 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -57.69 -60.23 4.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.27 -0.877 . . . . 0.11 109.169 178.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.646 HG21 HG11 ' A' ' 72' ' ' VAL . 20.7 pt -57.69 -7.09 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 114.585 -1.189 . . . . 0.2 111.662 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.443 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.1 m-30 -109.14 -13.77 14.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.322 -0.399 . . . . 0.19 111.37 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 50' ' ' THR . 48.4 mt -62.84 -165.55 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.483 0.659 . . . . 0.14 111.007 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.566 ' HA ' HD21 ' A' ' 66' ' ' LEU . 11.9 m-20 -150.77 170.22 19.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.204 -0.907 . . . . 1.31 109.772 178.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.6 ' H ' HD11 ' A' ' 66' ' ' LEU . 1.7 p-10 -48.31 -53.23 18.12 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.056 0.455 . . . . 1.73 110.11 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 37.4 tt0 -51.73 -59.4 4.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.576 -0.738 . . . . 0.52 110.92 179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.897 HG21 HD22 ' A' ' 46' ' ' LEU . 34.4 m -47.92 -50.93 25.28 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.44 -0.346 . . . . 0.19 110.934 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 35.6 mt -50.5 -39.05 47.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.535 . . . . 0.89 110.425 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 15.7 tt0 -67.73 -39.07 84.31 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.583 0.706 . . . . 0.52 109.129 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 13.6 mmmt -62.78 -28.45 69.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.65 -1.159 . . . . 2.19 110.381 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.877 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -78.96 -63.12 1.49 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.536 0.684 . . . . 1.2 109.166 178.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.476 ' O ' HD13 ' A' ' 57' ' ' LEU . . . -179.2 -19.17 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.59 0 CA-C-N 114.65 -1.159 . . . . 0.38 111.699 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.5 t -69.12 88.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.018 0.437 . . . . 0.89 109.827 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -87.4 -29.82 21.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.76 -0.655 . . . . 0.83 112.34 -177.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.89 111.26 1.4 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.006 0.373 . . . . 0.21 112.006 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.471 HD11 HH21 ' A' ' 62' ' ' ARG . 3.8 mm? -52.42 -27.87 17.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.441 -0.948 . . . . 0.27 108.441 177.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.83 -43.5 22.57 Favored Glycine 0 N--CA 1.441 -0.997 0 CA-C-N 114.775 -1.102 . . . . 0.14 112.81 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.796 ' HB1' HD11 ' A' ' 28' ' ' LEU . . . -73.28 -48.17 36.86 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 113.091 0.775 . . . . 0.16 113.091 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.579 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.8 ptt180 -68.25 -58.44 4.41 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.711 ' HA ' HD12 ' A' ' 66' ' ' LEU . 32.7 mtp180 -51.54 -23.43 4.11 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.714 -0.476 . . . . 2.47 109.714 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.3 mmtt -79.03 -41.2 29.46 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.834 -0.621 . . . . 2.52 110.692 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.526 HD11 ' HG ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.55 -28.09 59.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.478 . . . . 0.23 110.579 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 63' ' ' ARG . 1.8 mt -59.38 -23.95 63.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.989 -0.55 . . . . 0.15 110.068 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.498 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -75.95 -39.61 55.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.315 -0.995 . . . . 2.2 108.315 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.637 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -71.98 -22.76 61.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.052 -0.977 . . . . 0.23 110.289 179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.484 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.4 m-30 -70.97 -41.63 70.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.85 -0.614 . . . . 0.12 111.584 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.83 -46.06 25.02 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.897 -0.668 . . . . 0.13 113.967 -178.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.4 mt -54.23 -35.87 31.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.906 0.353 . . . . 0.25 110.823 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.646 HG11 HG21 ' A' ' 44' ' ' ILE . 57.4 t -71.06 -44.3 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.106 0.479 . . . . 0.15 110.437 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.583 HG13 HD12 ' A' ' 44' ' ' ILE . 42.7 mt -56.8 -53.97 35.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.377 -0.828 . . . . 0.28 111.916 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -56.09 -56.79 16.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.358 -0.383 . . . . 0.61 111.104 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.55 ' CD1' HD22 ' A' ' 80' ' ' LEU . 18.9 m-85 -57.14 -31.86 65.79 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.937 0.399 . . . . 1.41 110.028 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.548 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -63.65 -46.81 83.94 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.99 -1.115 . . . . 1.66 107.99 176.632 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.11 -25.07 66.02 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 113.64 -1.618 . . . . 1.16 112.201 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -90.45 16.02 9.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.672 0.273 . . . . 2.37 111.083 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t70 57.29 24.56 10.1 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.122 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.83 -24.0 26.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.821 -0.627 . . . . 0.5 110.671 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 11' ' ' THR . 65.2 mt -96.88 133.08 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.526 . . . . 0.18 110.119 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.513 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 15.0 t0 -57.44 129.94 44.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.283 -0.417 . . . . 0.47 110.364 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -60.22 -13.09 10.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.227 -0.442 . . . . 1.48 110.194 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.75 -33.88 76.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.851 -0.613 . . . . 1.09 110.151 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.59 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.69 -44.62 85.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.22 109.909 179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 2.5 m-85 . . . . . 0 C--O 1.25 1.081 0 CA-C-N 115.128 -0.942 . . . . 1.1 111.409 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.845 0.355 . . . . 5.27 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -147.31 107.34 4.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 3.86 110.907 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 64.9 p -73.21 87.53 1.45 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 1.79 110.876 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.8 p -101.6 151.28 22.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.026 -0.533 . . . . 1.99 110.867 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.634 ' HB3' HD11 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.01 -63.33 1.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.252 -0.431 . . . . 1.22 111.055 -179.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 10.9 m120 72.04 83.32 0.15 Allowed Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.928 -0.578 . . . . 1.72 111.831 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.688 ' HG2' ' HE3' ' A' ' 8' ' ' LYS . 12.3 Cg_endo -57.94 -6.99 3.01 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.447 2.098 . . . . 0.43 111.906 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.52 -50.68 10.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.502 -0.555 . . . . 1.39 109.502 178.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.4 m -76.87 -35.09 57.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.3 -0.864 . . . . 0.71 111.105 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 26' ' ' LEU . 24.1 mt -61.57 -12.73 16.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.5 111.27 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 4.5 p -124.73 20.95 8.46 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.71 -0.396 . . . . 0.35 111.35 -178.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.408 ' HB3' HD23 ' A' ' 15' ' ' LEU . 8.6 t70 -109.66 110.24 59.55 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 109.144 -0.688 . . . . 0.57 109.144 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.0 Cg_exo -44.62 -20.43 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.428 2.085 . . . . 0.13 113.759 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.462 ' NZ ' ' HG2' ' A' ' 21' ' ' MET . 0.0 OUTLIER -61.76 -47.98 82.74 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.543 -0.54 . . . . 1.37 109.543 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -77.11 -49.02 16.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.607 -0.724 . . . . 0.12 110.12 178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.659 HD21 ' O ' ' A' ' 10' ' ' LEU . 14.1 mt -50.42 -53.04 32.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.074 -0.966 . . . . 0.27 111.507 -179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.446 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 95.6 mttt -62.73 -29.79 70.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.88 109.885 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -110.82 66.89 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.545 -0.752 . . . . 0.53 109.02 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 38' ' ' THR . 22.1 mm -37.08 -50.17 2.2 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 115.911 -0.586 . . . . 0.49 111.997 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.441 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 96.8 Cg_exo -47.19 -50.64 10.77 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 121.548 1.499 . . . . 0.15 110.98 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.573 ' SD ' ' HD2' ' A' ' 24' ' ' LYS . 12.1 tpp -63.51 -43.44 97.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.961 -1.018 . . . . 0.94 109.297 178.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.641 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 70.9 t90 -52.88 -36.74 59.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.11 109.467 177.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 32' ' ' SER . 83.7 mt -77.06 -28.43 54.7 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.402 -0.817 . . . . 0.13 110.23 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HD2' ' SD ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.62 -40.89 69.39 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 121.101 0.476 . . . . 3.29 110.312 179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -75.74 -18.88 59.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.577 -0.738 . . . . 0.96 110.356 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.919 HD21 HD21 ' A' ' 10' ' ' LEU . 50.1 mt -98.74 -1.3 40.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.902 -0.59 . . . . 0.66 110.76 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 23.4 mmt180 65.86 15.24 9.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.853 -0.612 . . . . 4.34 111.229 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.572 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -107.49 22.62 15.7 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 116.393 -0.367 . . . . 0.67 110.483 179.133 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -60.54 -14.08 17.76 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.274 -1.38 . . . . 0.29 107.274 177.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -57.64 -34.23 69.11 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 113.872 -1.513 . . . . 0.72 109.184 177.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.62 ' CD2' HG13 ' A' ' 56' ' ' VAL . 41.1 m-85 -108.62 24.08 13.59 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.362 -1.29 . . . . 0.28 110.339 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.723 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.0 p -61.61 -43.72 98.32 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 115.689 -0.687 . . . . 1.3 110.216 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -64.35 -38.34 90.68 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.183 -0.462 . . . . 2.21 111.321 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.89 -20.9 48.3 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.159 0.429 . . . . 0.15 112.159 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -108.76 -12.8 14.88 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.227 0.454 . . . . 0.47 112.227 -178.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' SER . 79.7 p -65.05 -46.44 81.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 0.95 110.929 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.81 -15.56 4.88 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.77 -0.728 . . . . 0.15 112.158 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.61 ' O ' HG13 ' A' ' 19' ' ' ILE . 28.5 m -113.52 126.31 28.32 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.93 -0.135 . . . . 0.11 110.672 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 56.7 Cg_endo -66.03 -179.57 1.45 Allowed 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 123.047 2.498 . . . . 0.09 112.088 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.682 ' O ' HG12 ' A' ' 44' ' ' ILE . 50.6 p-90 -71.83 -49.54 37.54 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 120.502 -0.479 . . . . 0.21 109.951 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -49.83 -24.8 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.294 -0.412 . . . . 0.45 111.25 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -100.65 -35.85 9.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.708 -0.478 . . . . 2.15 109.708 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.03 -58.91 6.12 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 115.399 -0.819 . . . . 0.11 109.174 178.428 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 40' ' ' TRP . 40.2 pt -58.46 -8.2 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.35 -1.296 . . . . 0.2 111.443 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.41 ' HE1' HG12 ' A' ' 73' ' ' ILE . 3.6 m-30 -105.0 -15.41 15.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.19 111.212 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.905 HD22 HG21 ' A' ' 50' ' ' THR . 36.4 mt -62.33 -169.68 0.02 OUTLIER 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.123 0.487 . . . . 0.14 110.653 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.622 ' O ' HD13 ' A' ' 51' ' ' LEU . 9.4 m-20 -152.49 165.6 34.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.628 -0.715 . . . . 1.31 110.32 179.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.675 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.0 6.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.068 0.461 . . . . 1.73 110.047 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 42.3 tt0 -60.72 -59.64 5.06 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.744 -0.662 . . . . 0.52 111.112 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.905 HG21 HD22 ' A' ' 46' ' ' LEU . 33.0 m -48.97 -53.0 21.7 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-N 116.487 -0.324 . . . . 0.19 111.777 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 9.8 mp -49.07 -38.39 24.17 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.89 111.007 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.608 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 28.5 tt0 -66.5 -41.55 88.69 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.656 -0.868 . . . . 0.52 108.656 178.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.6 mmmm -60.94 -28.55 69.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.254 -1.339 . . . . 2.19 110.822 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.893 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -79.22 -59.16 2.88 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.635 0.731 . . . . 1.2 109.515 178.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.415 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 175.5 -17.99 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 114.525 -1.216 . . . . 0.38 111.402 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.709 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.11 83.41 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 109.412 -0.588 . . . . 0.89 109.412 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -85.36 -24.14 27.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 0.83 112.479 -177.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -62.77 110.35 1.72 Allowed 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 111.994 0.368 . . . . 0.21 111.994 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.46 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.9 mm? -51.56 -30.38 20.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.652 -0.869 . . . . 0.27 108.652 177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.46 -41.32 30.49 Favored Glycine 0 N--CA 1.441 -0.984 0 CA-C-N 115.02 -0.991 . . . . 0.14 112.722 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.69 -50.57 20.22 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.158 0.799 . . . . 0.16 113.158 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.608 ' NH1' ' HB2' ' A' ' 52' ' ' GLU . 14.6 ptt180 -66.38 -59.67 3.47 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.27 0.47 . . . . 0.81 112.27 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.746 ' HA ' HD12 ' A' ' 66' ' ' LEU . 67.1 mtp180 -49.87 -24.67 2.6 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.071 0.462 . . . . 2.47 109.877 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.1 mtpp -73.68 -45.82 50.13 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.709 -0.678 . . . . 2.52 111.318 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.67 -26.74 57.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.149 -0.478 . . . . 0.23 110.906 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.0 mt -59.09 -23.72 62.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.15 110.052 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.466 ' HE2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -77.82 -40.62 39.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.531 -0.915 . . . . 2.2 108.531 178.53 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.46 -22.45 61.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.043 -0.98 . . . . 0.23 110.372 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 15.6 m-30 -69.18 -42.25 76.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.791 -0.64 . . . . 0.12 111.717 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -44.0 30.71 Favored Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.602 -0.809 . . . . 0.13 113.784 -178.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.6 mt -54.23 -37.18 35.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.25 110.806 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 68' ' ' ALA . 65.3 t -71.16 -47.11 62.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.1 -0.5 . . . . 0.15 110.534 179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.741 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 40.2 mt -53.1 -50.94 43.18 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 CA-C-N 115.636 -0.711 . . . . 0.28 112.076 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -62.52 -59.55 4.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.065 -0.516 . . . . 0.61 111.505 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD1' HD22 ' A' ' 80' ' ' LEU . 14.2 m-85 -54.78 -31.3 58.66 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.274 -0.639 . . . . 1.41 109.274 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.741 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 11.2 ttmt -64.15 -46.06 85.73 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.351 -0.981 . . . . 1.66 108.351 176.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.561 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 28.4 mt-10 -69.42 -21.09 63.78 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 113.987 -1.461 . . . . 1.16 112.112 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -93.09 14.67 17.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.702 0.287 . . . . 2.37 111.017 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.1 t70 59.18 23.88 12.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.175 0.512 . . . . 2.13 110.024 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.518 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -83.35 -14.51 52.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.69 -0.686 . . . . 0.5 110.413 -179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.58 HD12 ' HB2' ' A' ' 76' ' ' LYS . 64.1 mt -107.46 134.23 49.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.719 -0.673 . . . . 0.18 110.198 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.523 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -58.04 130.92 48.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.274 -0.421 . . . . 0.47 110.043 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 32.5 mmm-85 -60.65 -12.88 11.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.152 -0.476 . . . . 1.48 110.659 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.3 t -66.87 -36.77 83.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 1.09 110.102 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.537 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -61.29 -44.04 97.87 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.074 -0.512 . . . . 0.22 110.011 179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.478 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.3 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-N 115.059 -0.973 . . . . 1.1 111.281 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.926 0.393 . . . . 5.27 110.922 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -142.37 65.99 1.34 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.175 -0.466 . . . . 3.86 110.842 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -88.3 79.37 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 1.79 110.648 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -89.59 141.64 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 1.99 111.277 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.501 ' HG3' ' HB2' ' A' ' 68' ' ' ALA . 0.1 OUTLIER -93.27 83.76 4.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.854 -0.612 . . . . 1.22 110.575 179.763 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.556 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.7 m120 -69.3 107.38 2.11 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.317 -0.401 . . . . 1.72 111.322 -179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HB3' ' HE2' ' A' ' 75' ' ' TYR . 28.1 Cg_exo -60.97 -10.26 14.36 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.335 2.023 . . . . 0.43 112.181 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -51.56 9.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.162 0.506 . . . . 1.39 110.013 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 27.4 m -76.93 -35.03 57.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.57 -0.741 . . . . 0.71 111.57 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 26' ' ' LEU . 59.5 mt -68.06 -8.13 35.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.403 -0.362 . . . . 0.5 111.143 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.553 ' HB ' HG12 ' A' ' 81' ' ' ILE . 12.1 p -128.78 17.74 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.468 -0.493 . . . . 0.35 111.509 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -110.16 111.91 57.76 Favored Pre-proline 0 N--CA 1.452 -0.336 0 N-CA-C 108.923 -0.769 . . . . 0.57 108.923 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.577 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 63.7 Cg_exo -44.47 -20.65 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.571 2.18 . . . . 0.13 113.888 -178.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.407 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.51 -49.78 76.18 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.35 -0.611 . . . . 1.37 109.35 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -76.9 -46.08 25.68 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.622 -0.717 . . . . 0.12 110.246 178.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 10' ' ' LEU . 16.6 mt -51.9 -49.32 63.28 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.277 -0.874 . . . . 0.27 111.351 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.0 mttt -67.95 -26.81 66.13 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.098 0.475 . . . . 0.88 109.897 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.537 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 31.4 t30 -111.7 67.59 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.491 -0.777 . . . . 0.53 108.971 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 38' ' ' THR . 18.3 mm -39.58 -50.63 5.17 Favored Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.367 -0.379 . . . . 0.49 111.954 -178.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.434 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 85.0 Cg_exo -47.09 -45.48 21.33 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.686 1.591 . . . . 0.15 110.677 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.537 ' HB2' ' ND2' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -66.23 -46.36 77.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.328 -1.305 . . . . 0.94 109.467 178.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 80.2 t90 -51.64 -36.71 47.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.735 -1.12 . . . . 0.11 110.651 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.766 HD12 ' HA ' ' A' ' 32' ' ' SER . 54.0 mt -75.47 -28.76 59.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.669 -0.696 . . . . 0.13 110.755 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -57.67 -41.47 81.61 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.158 -0.474 . . . . 3.29 110.375 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.9 m -74.41 -4.69 38.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.96 110.297 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.038 HD21 HD21 ' A' ' 10' ' ' LEU . 51.8 mt -116.4 2.04 13.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.912 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 66.79 12.56 8.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.685 -0.689 . . . . 4.34 111.55 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.687 ' HA ' ' HG3' ' A' ' 30' ' ' LYS . 1.1 mt -107.09 23.52 14.28 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.645 -0.252 . . . . 0.67 110.979 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.501 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 33.0 p-80 -60.29 -13.65 13.93 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 106.583 -1.636 . . . . 0.29 106.583 176.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.687 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 2.0 mtmt -55.89 -36.79 68.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 112.901 -1.954 . . . . 0.72 109.061 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.579 ' CD2' HG13 ' A' ' 56' ' ' VAL . 35.9 m-85 -108.6 25.15 12.06 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.234 -1.348 . . . . 0.28 110.977 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.766 ' HA ' HD12 ' A' ' 23' ' ' LEU . 5.0 m -62.71 -44.66 95.65 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.953 -0.567 . . . . 1.3 110.202 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -61.65 -38.42 87.64 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.03 -0.532 . . . . 2.21 111.322 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.427 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -79.05 -27.35 43.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.472 0.545 . . . . 0.15 112.472 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.646 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.12 -9.23 19.86 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.395 0.517 . . . . 0.47 112.395 -178.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 32' ' ' SER . 44.0 t -65.84 -45.78 80.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.73 0.3 . . . . 0.95 111.217 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.92 -11.23 4.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.729 . . . . 0.15 112.314 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.548 ' O ' HG13 ' A' ' 19' ' ' ILE . 27.2 m -118.14 127.29 26.69 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.249 0.071 . . . . 0.11 110.885 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.505 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.9 Cg_endo -66.47 -179.32 1.49 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.148 2.565 . . . . 0.09 111.977 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.697 ' O ' HG12 ' A' ' 44' ' ' ILE . 49.8 p-90 -72.43 -49.94 29.89 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.463 -0.495 . . . . 0.21 110.218 178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.483 HD12 ' HE2' ' A' ' 76' ' ' LYS . 5.2 tp -49.99 -25.33 2.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-O 120.83 0.348 . . . . 0.45 111.218 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -98.29 -37.4 9.67 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.604 -0.517 . . . . 2.15 109.604 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.646 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.4 -60.28 3.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.11 109.162 178.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.697 HG12 ' O ' ' A' ' 40' ' ' TRP . 38.5 pt -57.39 -12.06 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.253 -1.34 . . . . 0.2 111.659 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -100.76 -16.02 17.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.19 111.167 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 50' ' ' THR . 42.4 mt -62.6 -163.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.385 0.612 . . . . 0.14 110.761 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.62 170.96 18.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.292 -0.867 . . . . 1.31 110.138 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.579 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 1.1 p30 -48.86 -46.91 43.06 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.08 0.467 . . . . 1.73 110.453 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.591 ' HA ' ' NH1' ' A' ' 62' ' ' ARG . 21.7 tt0 -66.53 -50.69 62.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.746 -0.661 . . . . 0.52 112.773 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.861 HG21 HD22 ' A' ' 46' ' ' LEU . 89.4 m -49.03 -45.04 42.04 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 120.451 -0.5 . . . . 0.19 109.671 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.679 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 70.7 mt -50.37 -44.18 54.59 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.893 -1.049 . . . . 0.89 110.078 178.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.611 ' HB2' HH11 ' A' ' 62' ' ' ARG . 20.5 tt0 -60.76 -39.95 90.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.011 -0.995 . . . . 0.52 109.667 178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.44 ' CA ' ' HE3' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -64.61 -29.45 70.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.938 -0.574 . . . . 2.19 110.802 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -74.99 -59.48 2.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 1.2 109.518 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 174.87 -17.17 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 114.505 -1.225 . . . . 0.38 111.408 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 4.9 t -68.28 89.76 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.429 0 N-CA-C 109.231 -0.655 . . . . 0.89 109.231 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.45 27.34 4.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.152 -0.476 . . . . 0.83 112.272 -177.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -115.52 109.67 18.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.931 0.345 . . . . 0.21 111.931 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD1' HH21 ' A' ' 62' ' ' ARG . 1.9 mm? -48.5 -29.74 4.47 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.06 -0.719 . . . . 0.27 109.06 178.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.7 -47.1 12.59 Favored Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 114.98 -1.009 . . . . 0.14 112.578 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.24 -29.49 61.72 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.766 0.654 . . . . 0.16 112.766 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.623 ' HA ' HD13 ' A' ' 51' ' ' LEU . 49.1 mtm180 -72.89 -65.77 0.75 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.81 111.55 -178.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HA ' HD12 ' A' ' 66' ' ' LEU . 82.0 mtt180 -55.1 -17.39 4.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.648 -0.705 . . . . 2.47 109.595 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 10.1 mptt -74.57 -51.59 14.18 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.385 -0.825 . . . . 2.52 110.553 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -53.43 -28.99 33.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.596 -0.729 . . . . 0.23 110.918 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.5 mt -58.71 -27.47 64.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.15 110.694 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.464 ' HB3' ' HE2' ' A' ' 67' ' ' LYS . 8.7 mmmm -71.6 -40.82 69.59 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.665 -0.865 . . . . 2.2 108.665 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.675 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.32 -22.38 61.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.749 -1.114 . . . . 0.23 110.302 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.504 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 14.7 m-30 -71.66 -43.81 65.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.741 -0.663 . . . . 0.12 112.03 -179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.15 -48.59 14.8 Favored Glycine 0 CA--C 1.517 0.157 0 C-N-CA 120.757 -0.735 . . . . 0.13 114.38 -178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 14.8 mt -53.71 -33.68 23.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.977 0.388 . . . . 0.25 111.093 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 68' ' ' ALA . 88.2 t -71.29 -48.78 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.427 -0.351 . . . . 0.15 110.32 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.773 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 62.2 mt -54.27 -51.35 48.88 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.694 -0.684 . . . . 0.28 111.952 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.32 -60.18 4.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.819 -0.628 . . . . 0.61 111.248 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.534 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.0 m-85 -56.91 -31.5 64.97 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.508 0.67 . . . . 1.41 109.387 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' A' ' 73' ' ' ILE . 7.8 ttmt -67.4 -41.13 85.43 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.087 -0.96 . . . . 1.66 108.818 177.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 13.3 mt-10 -75.08 -17.27 60.49 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 113.918 -1.492 . . . . 1.16 111.206 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -97.19 19.93 12.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.301 -0.409 . . . . 2.37 110.687 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.95 26.73 6.56 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.955 -0.566 . . . . 2.13 110.551 -179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -87.61 -9.98 52.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.802 -0.635 . . . . 0.5 110.695 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.643 HD12 ' HB2' ' A' ' 76' ' ' LYS . 52.0 mt -112.15 136.86 47.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.894 -0.594 . . . . 0.18 110.281 179.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.3 t70 -61.0 133.23 55.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.232 -0.44 . . . . 0.47 110.597 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 20.5 mmt85 -61.88 -12.71 19.14 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.062 -0.517 . . . . 1.48 110.612 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.2 t -67.94 -36.23 79.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 1.09 110.198 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.577 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -60.31 -44.68 95.21 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.082 0.468 . . . . 0.22 109.961 179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.502 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.5 m-85 . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.014 -0.994 . . . . 1.1 111.376 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.636 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 43.0 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.755 0.312 . . . . 5.27 110.941 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -170.34 136.61 1.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 3.86 111.071 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 78.0 p -90.3 110.84 21.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.102 -0.499 . . . . 1.79 110.681 179.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.4 m -107.76 1.35 22.88 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.421 -0.354 . . . . 1.99 111.534 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.56 59.85 2.78 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.279 -0.419 . . . . 1.22 111.257 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.55 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 15.7 m120 -58.14 108.35 1.26 Allowed Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.342 -0.39 . . . . 1.72 110.976 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.758 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 42.2 Cg_endo -69.52 -8.54 23.87 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 121.737 1.624 . . . . 0.43 111.977 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.758 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -80.18 -52.72 7.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.302 0.572 . . . . 1.39 110.364 178.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.5 t -76.49 -38.31 55.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.29 -0.868 . . . . 0.71 111.796 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 26' ' ' LEU . 36.4 mt -66.01 -8.06 20.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.572 -0.285 . . . . 0.5 111.4 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.554 HG21 ' CD2' ' A' ' 75' ' ' TYR . 20.0 p -124.0 22.19 8.83 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.385 -0.526 . . . . 0.35 111.305 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 14' ' ' LYS . 9.9 t70 -110.35 116.47 52.92 Favored Pre-proline 0 C--N 1.328 -0.369 0 N-CA-C 108.502 -0.925 . . . . 0.57 108.502 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 62.8 Cg_exo -44.46 -20.11 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.257 1.971 . . . . 0.13 113.711 -178.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.99 -54.8 40.48 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.783 -0.451 . . . . 1.37 109.783 179.569 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -72.88 -45.02 60.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.915 -0.584 . . . . 0.12 110.489 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.754 HD21 ' O ' ' A' ' 10' ' ' LEU . 17.5 mt -51.93 -48.38 64.27 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.331 -0.85 . . . . 0.27 111.508 -178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 85' ' ' ALA . 93.3 mttt -68.85 -25.93 64.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.88 110.036 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -113.29 67.76 0.67 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.83 -0.804 . . . . 0.53 108.83 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 38' ' ' THR . 22.2 mm -39.23 -49.93 4.55 Favored Pre-proline 0 C--O 1.226 -0.165 0 CA-C-N 116.074 -0.512 . . . . 0.49 112.094 -178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.458 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 92.5 Cg_exo -47.09 -43.82 24.45 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 121.643 1.562 . . . . 0.15 111.045 178.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.549 ' O ' ' HB3' ' A' ' 24' ' ' LYS . 4.8 tpp -72.23 -41.29 67.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.753 -1.112 . . . . 0.94 109.719 179.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 84.1 t90 -54.49 -34.22 61.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.628 -0.715 . . . . 0.11 109.488 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD12 ' HA ' ' A' ' 32' ' ' SER . 47.3 mt -76.28 -26.82 56.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.907 -1.042 . . . . 0.13 110.652 178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -62.46 -38.21 88.93 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 109.713 -0.477 . . . . 3.29 109.713 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.7 m -72.22 -8.99 57.79 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.534 -0.543 . . . . 0.96 109.534 178.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 10' ' ' LEU . 59.5 mt -115.05 1.67 13.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.289 -0.869 . . . . 0.66 110.168 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.636 ' HE ' ' HA ' ' A' ' 1' ' ' SER . 23.3 mmt180 66.08 5.45 3.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.418 -0.81 . . . . 4.34 111.593 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' CD2' ' HB1' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -96.12 22.73 7.24 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.669 -0.241 . . . . 0.67 111.118 179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.474 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 21.7 p-80 -60.09 -13.54 12.34 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.599 -1.26 . . . . 0.29 107.599 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.067 -1.424 . . . . 0.72 109.278 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.484 ' CG ' HG22 ' A' ' 56' ' ' VAL . 47.0 m-85 -98.4 22.56 9.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.694 -1.139 . . . . 0.28 110.88 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.705 ' HA ' HD12 ' A' ' 23' ' ' LEU . 7.2 m -60.85 -46.09 91.95 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.289 -0.414 . . . . 1.3 110.051 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.89 -41.14 81.93 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.961 -0.563 . . . . 2.21 110.936 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.5 -25.26 45.63 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.83 0.678 . . . . 0.15 112.83 -179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.562 ' HB2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -106.4 -7.1 17.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.451 0.537 . . . . 0.47 112.451 -178.192 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 32' ' ' SER . 34.1 t -68.32 -46.9 68.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.95 111.086 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.15 -15.18 5.04 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.819 -0.705 . . . . 0.15 112.12 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.568 ' O ' HG13 ' A' ' 19' ' ' ILE . 22.0 m -112.2 125.19 30.56 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 115.932 -0.134 . . . . 0.11 110.776 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.491 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 58.2 Cg_endo -66.73 -179.29 1.57 Allowed 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.028 2.485 . . . . 0.09 111.801 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.659 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.6 p-90 -72.09 -48.54 43.32 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 120.46 -0.496 . . . . 0.21 110.067 179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.466 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -50.57 -26.02 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.817 0.341 . . . . 0.45 110.929 -179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -98.78 -34.58 10.45 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 2.15 109.692 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.561 HD23 ' O ' ' A' ' 38' ' ' THR . 0.3 OUTLIER -59.44 -58.41 8.71 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.858 -0.793 . . . . 0.11 108.858 178.377 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 40' ' ' TRP . 28.4 pt -56.47 -8.67 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.317 -1.31 . . . . 0.2 111.596 178.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -107.81 -15.15 14.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.19 111.602 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 50' ' ' THR . 36.1 mt -62.28 -170.0 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.218 0.533 . . . . 0.14 110.74 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.579 ' O ' HD13 ' A' ' 51' ' ' LEU . 16.0 m-20 -154.82 166.93 31.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.422 -0.808 . . . . 1.31 110.127 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.773 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -44.17 -43.73 7.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.146 0.498 . . . . 1.73 109.806 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -57.84 -64.9 0.75 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.741 -0.663 . . . . 0.52 111.203 179.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.892 HG21 HD22 ' A' ' 46' ' ' LEU . 64.1 m -47.57 -53.18 15.31 Favored 'General case' 0 N--CA 1.461 0.085 0 N-CA-C 111.791 0.293 . . . . 0.19 111.791 -178.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.626 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 8.7 mp -49.43 -40.72 37.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.448 -0.342 . . . . 0.89 110.886 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HB3' ' HE2' ' A' ' 53' ' ' LYS . 28.8 tt0 -58.26 -48.76 79.42 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.703 -0.851 . . . . 0.52 108.703 178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.546 ' HE2' ' HB3' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -55.68 -36.08 66.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.89 -1.05 . . . . 2.19 112.115 179.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 50' ' ' THR . 2.1 mmmt -68.85 -52.9 24.96 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.596 0.712 . . . . 1.2 109.489 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.72 -14.4 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 114.533 -1.212 . . . . 0.38 111.49 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.626 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 9.1 t -69.94 84.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 121.14 0.495 . . . . 0.89 109.779 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.41 -16.7 34.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.568 -0.742 . . . . 0.83 112.377 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -71.35 107.54 4.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.693 -0.23 . . . . 0.21 111.308 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.3 mm? -50.55 -29.48 10.78 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.73 -0.841 . . . . 0.27 108.73 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.03 -40.74 34.2 Favored Glycine 0 N--CA 1.439 -1.134 0 CA-C-N 115.033 -0.985 . . . . 0.14 112.227 178.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.63 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.49 -54.86 7.24 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 113.252 0.834 . . . . 0.16 113.252 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 18.3 ptt180 -63.71 -61.4 2.33 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 112.33 0.493 . . . . 0.81 112.33 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.748 ' HA ' HD12 ' A' ' 66' ' ' LEU . 69.1 mtm180 -48.62 -22.85 0.84 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.21 -0.45 . . . . 2.47 110.169 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 7.3 mtmm -76.72 -46.52 25.11 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.229 -0.441 . . . . 2.52 110.986 178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.552 ' CD1' HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -54.58 -28.71 48.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.017 -0.538 . . . . 0.23 110.708 179.699 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.773 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.2 mt -55.61 -26.55 44.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.998 -0.547 . . . . 0.15 110.246 178.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 ttpm? -77.67 -39.26 45.47 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.961 -0.755 . . . . 2.2 108.961 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.625 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -69.66 -22.52 63.44 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.054 -0.976 . . . . 0.23 110.059 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.496 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -71.57 -42.57 67.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.671 . . . . 0.12 111.288 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.09 -44.35 29.91 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.631 -0.795 . . . . 0.13 113.379 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.3 mt -54.67 -37.88 41.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.25 110.531 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 68' ' ' ALA . 85.9 t -71.18 -47.29 61.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.15 110.269 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.564 ' CG1' HD12 ' A' ' 44' ' ' ILE . 36.5 mt -52.37 -54.52 14.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.305 -0.862 . . . . 0.28 111.297 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -50.86 -55.36 17.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.208 -0.451 . . . . 0.61 111.525 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.554 ' CD2' HG21 ' A' ' 11' ' ' THR . 3.2 m-30 -60.74 -32.08 71.37 Favored 'General case' 0 CA--C 1.521 -0.141 0 N-CA-C 109.751 -0.463 . . . . 1.41 109.751 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.597 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.81 -35.75 77.37 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.503 -0.925 . . . . 1.66 108.503 177.625 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 24.4 mt-10 -76.7 -24.45 53.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.546 -1.206 . . . . 1.16 111.341 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -95.43 13.13 26.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.029 -0.532 . . . . 2.37 111.85 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.3 t0 59.63 23.65 12.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.214 0.531 . . . . 2.13 110.416 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -84.06 -20.42 32.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.963 -0.562 . . . . 0.5 110.431 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' A' ' 76' ' ' LYS . 76.4 mt -99.96 133.36 43.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.816 -0.629 . . . . 0.18 110.326 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.471 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 8.6 t70 -59.56 132.8 55.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.47 110.617 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.623 HH11 ' HG2' ' A' ' 83' ' ' ARG . 1.9 mmt-85 -61.82 -12.66 18.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 1.48 110.504 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 t -66.0 -35.74 81.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.07 -0.513 . . . . 1.09 110.131 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.594 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.61 -41.41 90.28 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.245 0.545 . . . . 0.22 110.032 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 4.3 m-85 . . . . . 0 C--O 1.248 0.992 0 CA-C-N 114.98 -1.009 . . . . 1.1 111.129 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.805 0.336 . . . . 5.27 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.2 t30 55.03 85.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 3.86 111.068 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.5 t -55.33 -66.37 0.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.112 -0.495 . . . . 1.79 110.793 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.8 t 53.75 93.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.119 -0.491 . . . . 1.99 111.14 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.554 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER -50.4 98.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 1.22 111.086 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.5 m120 -80.3 107.31 6.74 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.275 -0.421 . . . . 1.72 110.778 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.464 ' HD3' ' O ' ' A' ' 5' ' ' MET . 32.3 Cg_exo -60.87 -17.73 52.56 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.034 1.822 . . . . 0.43 112.423 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.587 ' HD2' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -79.96 -51.47 9.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.871 0.367 . . . . 1.39 111.051 179.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.46 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 10.3 t -76.38 -44.2 37.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.54 . . . . 0.71 111.644 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 26' ' ' LEU . 84.2 mt -60.26 -11.45 6.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.5 111.311 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.576 ' HB ' HG12 ' A' ' 81' ' ' ILE . 13.1 p -125.07 23.87 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.375 -0.53 . . . . 0.35 111.545 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 9.3 t70 -110.16 114.58 55.66 Favored Pre-proline 0 N--CA 1.45 -0.474 0 N-CA-C 108.301 -1.0 . . . . 0.57 108.301 178.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.584 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 67.1 Cg_exo -44.23 -19.68 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.297 1.998 . . . . 0.13 113.748 -178.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.95 -53.32 58.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.512 -0.551 . . . . 1.37 109.512 179.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.597 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.04 -42.15 57.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.74 -0.664 . . . . 0.12 110.47 178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.73 HD21 ' O ' ' A' ' 10' ' ' LEU . 25.7 mt -53.61 -43.23 68.46 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.188 -0.915 . . . . 0.27 111.389 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 92.4 mttt -78.51 -21.68 48.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.391 0.615 . . . . 0.88 109.365 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -111.32 59.72 0.61 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.06 -0.973 . . . . 0.53 108.755 178.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 38' ' ' THR . 16.5 mm -35.86 -51.81 1.55 Allowed Pre-proline 0 N--CA 1.464 0.273 0 CA-C-N 116.113 -0.494 . . . . 0.49 112.076 -178.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.453 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 86.0 Cg_exo -47.15 -48.43 14.81 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.646 1.564 . . . . 0.15 110.764 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.475 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.74 -40.98 88.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.444 -1.253 . . . . 0.94 109.652 178.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.5 t90 -54.02 -36.14 62.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.402 0.62 . . . . 0.11 109.607 177.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' SER . 80.1 mt -76.39 -25.56 54.7 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.043 -0.981 . . . . 0.13 110.445 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.0 OUTLIER -54.9 -47.61 74.12 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.222 0.534 . . . . 3.29 110.323 178.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.0 m -68.89 -9.04 49.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.442 -0.799 . . . . 0.96 110.494 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.033 HD21 HD21 ' A' ' 10' ' ' LEU . 28.6 mt -117.05 9.85 13.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.825 -0.625 . . . . 0.66 109.596 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 7.3 ptt180 53.32 4.86 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 O-C-N 124.345 1.028 . . . . 4.34 111.999 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HE3' ' A' ' 30' ' ' LYS . 6.2 mt -88.98 19.42 4.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.509 0.195 . . . . 0.67 110.611 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 41.7 p-80 -60.75 -14.8 23.5 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 107.201 -1.407 . . . . 0.29 107.201 177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.831 ' HE3' HD23 ' A' ' 28' ' ' LEU . 1.5 pttt -56.5 -32.21 64.81 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 113.397 -1.729 . . . . 0.72 108.802 177.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.608 ' CD2' HG13 ' A' ' 56' ' ' VAL . 40.1 m-85 -109.68 27.86 9.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.052 -1.431 . . . . 0.28 110.308 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.568 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.2 t -64.01 -50.64 67.68 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 115.705 -0.679 . . . . 1.3 110.585 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -56.1 -40.75 74.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.177 -0.465 . . . . 2.21 111.102 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -74.47 -31.36 62.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.653 -0.703 . . . . 0.15 112.631 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -101.4 -8.31 22.13 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.602 0.594 . . . . 0.47 112.602 -178.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.476 ' N ' ' O ' ' A' ' 32' ' ' SER . 44.6 t -68.27 -45.56 72.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.665 0.269 . . . . 0.95 111.329 -178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.27 -11.46 4.94 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.67 -0.776 . . . . 0.15 112.026 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.565 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.7 m -115.59 125.53 28.67 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.96 -0.12 . . . . 0.11 111.077 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.504 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.2 Cg_endo -65.81 -179.16 1.2 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 123.052 2.501 . . . . 0.09 111.582 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.66 ' O ' HG12 ' A' ' 44' ' ' ILE . 39.9 p-90 -72.49 -49.87 30.01 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 120.438 -0.505 . . . . 0.21 110.183 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 2.9 tp -50.4 -24.83 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.895 0.378 . . . . 0.45 110.938 -179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -98.71 -36.87 9.7 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.527 -0.545 . . . . 2.15 109.527 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -56.95 -60.07 4.13 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.431 -0.804 . . . . 0.11 108.906 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 40' ' ' TRP . 29.8 pt -57.92 -7.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 114.363 -1.29 . . . . 0.2 111.368 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -106.57 -16.97 14.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.183 -0.462 . . . . 0.19 111.37 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 HG21 ' A' ' 50' ' ' THR . 43.4 mt -62.02 -168.08 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.346 0.593 . . . . 0.14 110.687 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.547 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.8 m-20 -152.44 170.94 18.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.193 -0.912 . . . . 1.31 110.031 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.703 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.68 -48.75 28.99 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.997 -0.547 . . . . 1.73 110.213 179.284 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.71 -50.49 73.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.576 -0.738 . . . . 0.52 112.257 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.865 HG21 HD22 ' A' ' 46' ' ' LEU . 99.8 m -59.08 -49.41 77.98 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.666 0.27 . . . . 0.19 111.192 -179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.68 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 53.6 mt -50.53 -41.92 54.4 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.012 -0.54 . . . . 0.89 110.37 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.581 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.3 tt0 -59.83 -45.73 91.47 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.102 -0.703 . . . . 0.52 109.102 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.457 ' HE2' ' N ' ' A' ' 53' ' ' LYS . 1.9 mmpt? -56.72 -34.67 67.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.756 -1.111 . . . . 2.19 111.038 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.6 mmmt -71.62 -58.07 3.83 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.668 0.747 . . . . 1.2 109.62 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.8 -16.59 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.57 -1.195 . . . . 0.38 111.533 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.68 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.41 80.85 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.487 -0.561 . . . . 0.89 109.487 178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.48 -24.43 34.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.585 -0.734 . . . . 0.83 112.112 -178.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -61.83 110.18 1.46 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.515 -0.311 . . . . 0.21 111.585 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.471 HD12 ' NE ' ' A' ' 63' ' ' ARG . 4.1 mm? -52.82 -27.98 20.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.587 -0.894 . . . . 0.27 108.587 178.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.75 -40.66 30.8 Favored Glycine 0 N--CA 1.441 -1.015 0 CA-C-N 114.922 -1.036 . . . . 0.14 112.729 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.13 -53.31 10.16 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 113.267 0.84 . . . . 0.16 113.267 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.636 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.4 ptt180 -65.01 -60.39 3.1 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 112.389 0.515 . . . . 0.81 112.389 -177.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 81.5 mtt180 -49.92 -26.14 3.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.081 0.467 . . . . 2.47 109.768 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.554 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 62.7 tttp -77.17 -40.07 46.71 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.673 -0.694 . . . . 2.52 110.9 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.694 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -56.89 -28.13 61.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.23 110.349 179.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.703 HD11 ' H ' ' A' ' 48' ' ' ASP . 2.7 mt -60.81 -21.79 63.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.668 -0.696 . . . . 0.15 110.61 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -78.78 -38.17 39.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.636 -0.875 . . . . 2.2 108.636 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.54 -23.18 59.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.123 -0.944 . . . . 0.23 110.303 178.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.493 ' HE1' HD12 ' A' ' 43' ' ' LEU . 15.6 m-30 -68.73 -40.31 79.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.789 -0.641 . . . . 0.12 111.985 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.93 -51.34 9.21 Favored Glycine 0 C--N 1.33 0.197 0 C-N-CA 120.717 -0.754 . . . . 0.13 114.629 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 12.6 mt -53.94 -33.76 24.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.989 0.395 . . . . 0.25 111.351 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 68' ' ' ALA . 96.6 t -70.83 -42.08 77.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.135 0.493 . . . . 0.15 110.429 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.659 HG13 HD12 ' A' ' 44' ' ' ILE . 46.8 mt -58.51 -59.17 3.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.372 -0.831 . . . . 0.28 111.727 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 78' ' ' ARG . 4.8 t70 -53.35 -51.33 62.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.61 -0.268 . . . . 0.61 111.262 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.562 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.4 m-30 -59.43 -32.78 70.51 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.723 -0.473 . . . . 1.41 109.723 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HA ' ' HB ' ' A' ' 81' ' ' ILE . 0.7 OUTLIER -62.99 -48.43 78.88 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 122.505 1.145 . . . . 1.66 108.061 176.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 7.8 mt-10 -75.0 -12.87 60.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 112.729 -2.032 . . . . 1.16 112.517 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 80' ' ' LEU . 72.9 mtp180 -100.94 28.73 5.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.805 0.336 . . . . 2.37 110.389 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 47.96 22.86 0.42 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.626 -0.715 . . . . 2.13 111.043 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.433 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -88.03 -24.02 23.61 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.053 -0.521 . . . . 0.5 110.221 179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.576 HG12 ' HB ' ' A' ' 11' ' ' THR . 42.5 mt -101.12 133.06 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.196 0 CA-C-N 115.98 -0.555 . . . . 0.18 110.401 178.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.501 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.4 t70 -61.55 137.59 58.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.47 110.616 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.423 ' O ' ' HB2' ' A' ' 86' ' ' TYR . 18.9 mmt85 -63.71 -13.45 43.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 1.48 110.012 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.6 m -65.1 -31.04 72.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.87 -0.605 . . . . 1.09 110.129 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.584 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -68.48 -42.96 77.95 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.22 109.785 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.51 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.248 1.005 0 CA-C-N 114.951 -1.022 . . . . 1.1 111.369 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.9 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.836 0.351 . . . . 5.27 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -100.42 -178.05 3.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 3.86 110.843 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.684 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 31.4 p -162.09 32.82 0.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.49 . . . . 1.79 110.797 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.3 m -90.02 13.72 14.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 1.99 110.555 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.522 ' HA ' HD11 ' A' ' 10' ' ' LEU . 0.6 OUTLIER 60.08 72.99 0.5 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.61 -0.723 . . . . 1.22 111.412 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.3 t-20 -70.06 108.71 3.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.139 -0.482 . . . . 1.72 110.464 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.778 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 20.9 Cg_endo -64.26 -15.17 48.06 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.939 1.759 . . . . 0.43 113.132 -178.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.778 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.59 -46.81 16.57 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.508 -0.477 . . . . 1.39 110.14 178.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.44 ' OG ' ' HG ' ' A' ' 15' ' ' LEU . 20.0 t -77.04 -45.77 26.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.502 -0.772 . . . . 0.71 111.683 -179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 26' ' ' LEU . 73.1 mt -59.88 -9.7 3.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.225 -0.443 . . . . 0.5 111.515 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.518 HG21 ' CD2' ' A' ' 75' ' ' TYR . 17.7 p -124.04 22.56 8.73 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.342 -0.543 . . . . 0.35 111.455 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 15.3 t70 -110.12 115.19 55.09 Favored Pre-proline 0 N--CA 1.451 -0.406 0 N-CA-C 108.511 -0.922 . . . . 0.57 108.511 179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HA ' HD12 ' A' ' 16' ' ' LEU . 69.2 Cg_exo -44.49 -19.84 0.29 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.543 2.162 . . . . 0.13 114.091 -178.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.51 -52.0 65.21 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.511 -0.475 . . . . 1.37 109.789 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.4 mm? -73.03 -45.46 57.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.854 -0.612 . . . . 0.12 110.248 179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.674 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -52.38 -50.82 61.66 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.247 -0.888 . . . . 0.27 111.557 -179.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -65.92 -25.54 67.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.071 0.462 . . . . 0.88 110.147 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.89 66.76 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.916 -0.772 . . . . 0.53 108.916 178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 38' ' ' THR . 23.5 mm -36.89 -49.75 2.04 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 115.781 -0.645 . . . . 0.49 112.132 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.436 ' HD3' ' HB ' ' A' ' 19' ' ' ILE . 99.8 Cg_exo -46.94 -51.51 9.15 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 121.507 1.471 . . . . 0.15 110.909 178.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.569 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 8.7 tpp -62.76 -42.78 99.84 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.867 -1.06 . . . . 0.94 109.464 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.628 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.8 t90 -53.89 -37.45 63.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.799 -0.637 . . . . 0.11 109.55 177.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.8 mt -76.49 -27.49 56.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.097 -0.956 . . . . 0.13 110.01 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HE2' ' HB3' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.72 -38.12 71.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.116 -0.493 . . . . 3.29 110.247 178.744 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.4 m -75.42 -10.64 59.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.96 109.857 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.963 HD21 HD21 ' A' ' 10' ' ' LEU . 19.6 mt -117.22 13.19 14.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.475 -0.784 . . . . 0.66 109.213 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.686 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 5.9 ptm180 53.56 -0.34 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.378 1.049 . . . . 4.34 112.331 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.635 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mt -82.79 18.78 1.48 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.804 -0.358 . . . . 0.67 110.905 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.625 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 21.6 p-80 -57.04 -14.87 4.13 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.511 -1.292 . . . . 0.29 107.511 177.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' A' ' 28' ' ' LEU . 14.0 pttt -55.24 -47.73 74.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 113.687 -1.597 . . . . 0.72 108.497 177.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.607 ' CD2' HG13 ' A' ' 56' ' ' VAL . 38.5 m-85 -94.91 23.83 5.25 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 113.687 -1.597 . . . . 0.28 110.788 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 23' ' ' LEU . 90.6 p -63.03 -43.24 99.24 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 116.112 -0.495 . . . . 1.3 110.325 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -62.52 -38.16 88.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.107 -0.497 . . . . 2.21 110.97 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -26.33 47.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.15 112.488 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -103.89 -11.96 17.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.176 0.435 . . . . 0.47 112.176 -178.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.9 t -65.46 -46.83 78.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.825 0.345 . . . . 0.95 110.753 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.97 -16.88 6.51 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.876 -0.678 . . . . 0.15 111.912 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.598 ' O ' HG13 ' A' ' 19' ' ' ILE . 24.2 m -112.32 125.31 30.31 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 110.463 -0.199 . . . . 0.11 110.463 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 57.3 Cg_endo -65.8 -179.49 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.033 2.489 . . . . 0.09 111.833 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.656 ' O ' HG12 ' A' ' 44' ' ' ILE . 42.1 p-90 -72.13 -49.54 35.17 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.539 -0.464 . . . . 0.21 109.892 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.534 HD11 ' NZ ' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -49.63 -27.0 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.45 110.942 -179.244 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -97.05 -36.82 10.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.355 -0.609 . . . . 2.15 109.355 179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.609 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.86 -60.84 2.98 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.36 -0.837 . . . . 0.11 109.226 178.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 40' ' ' TRP . 26.1 pt -54.32 -15.47 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 114.463 -1.244 . . . . 0.2 111.436 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.2 m-30 -101.53 -14.38 17.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.575 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.843 HD22 HG21 ' A' ' 50' ' ' THR . 44.5 mt -62.97 -166.94 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.343 0.592 . . . . 0.14 110.566 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.469 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.1 m-20 -152.57 170.17 20.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.27 -0.877 . . . . 1.31 109.832 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.612 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.1 p-10 -48.17 -48.86 34.27 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.53 -0.544 . . . . 1.73 109.53 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.4 tt0 -53.28 -60.56 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.417 -0.811 . . . . 0.52 110.867 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.932 HG22 ' HD3' ' A' ' 54' ' ' LYS . 16.8 m -50.05 -50.33 48.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 O-C-N 123.139 0.274 . . . . 0.19 110.718 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.673 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 58.5 mt -49.74 -38.33 33.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.924 -0.58 . . . . 0.89 110.374 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.51 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 25.1 tt0 -68.01 -40.78 82.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.876 -0.787 . . . . 0.52 108.876 178.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.4 mmmm -61.73 -29.84 70.38 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.435 -1.257 . . . . 2.19 110.951 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.932 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.7 OUTLIER -77.87 -57.45 3.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.526 0.679 . . . . 1.2 109.393 178.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 173.5 -17.5 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 114.676 -1.147 . . . . 0.38 111.512 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.9 t -70.51 81.59 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 109.557 -0.534 . . . . 0.89 109.557 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -81.93 -26.16 34.27 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.608 -0.723 . . . . 0.83 112.057 -178.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -60.55 110.95 1.41 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 116.427 -0.351 . . . . 0.21 111.868 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.446 ' CD1' HH21 ' A' ' 62' ' ' ARG . 3.7 mm? -52.52 -29.09 23.42 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.616 -0.883 . . . . 0.27 108.616 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.59 17.4 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 114.911 -1.04 . . . . 0.14 112.706 179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -69.39 -48.97 59.51 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.085 0.772 . . . . 0.16 113.085 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.621 ' HA ' HD13 ' A' ' 51' ' ' LEU . 15.1 ptt180 -68.04 -59.41 3.28 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.309 0.485 . . . . 0.81 112.309 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.722 ' HA ' HD12 ' A' ' 66' ' ' LEU . 21.0 mtp180 -50.65 -23.28 2.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.954 0.406 . . . . 2.47 109.928 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 30.6 mtpt -77.67 -42.8 33.39 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.922 -0.581 . . . . 2.52 110.772 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.79 -28.72 57.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.23 110.602 179.369 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.2 mt -59.62 -24.14 63.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.755 -0.657 . . . . 0.15 110.542 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.476 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 1.5 tmmm? -78.36 -36.82 45.59 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.813 -0.81 . . . . 2.2 108.813 179.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.659 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.0 -27.12 61.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.201 -0.908 . . . . 0.23 110.29 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.495 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -66.48 -42.35 87.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.793 -0.639 . . . . 0.12 111.523 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.41 -46.77 46.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.931 -0.652 . . . . 0.13 113.967 -178.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.51 -36.71 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.25 110.627 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.659 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.2 t -71.67 -47.21 58.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.046 -0.524 . . . . 0.15 110.144 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.504 HG12 HD12 ' A' ' 44' ' ' ILE . 35.1 mt -54.63 -39.69 47.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.461 -0.791 . . . . 0.28 111.595 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.96 -60.69 2.95 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.889 -0.596 . . . . 0.61 111.157 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CD2' HG21 ' A' ' 11' ' ' THR . 2.7 m-30 -55.9 -31.56 62.95 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.688 -0.856 . . . . 1.41 108.688 178.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.534 ' NZ ' HD11 ' A' ' 41' ' ' ILE . 1.8 tttm -66.74 -40.38 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.884 -1.053 . . . . 1.66 108.88 177.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.12 -22.13 58.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.594 -1.184 . . . . 1.16 111.375 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 80.7 mtp180 -96.34 18.54 13.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 2.37 111.281 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 50.74 30.15 4.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 2.13 110.92 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -85.19 -42.93 14.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.89 -0.595 . . . . 0.5 110.598 -179.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 76' ' ' LYS . 81.8 mt -71.06 136.01 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.18 110.16 178.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.502 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 4.9 t70 -60.35 133.75 56.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.368 -0.378 . . . . 0.47 110.584 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 18.3 mmt85 -61.35 -12.93 15.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.077 -0.51 . . . . 1.48 110.506 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 68.7 m -63.93 -37.29 86.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.014 -0.539 . . . . 1.09 109.742 178.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.467 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -65.47 -43.28 90.8 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.22 110.036 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD1' ' HA ' ' A' ' 83' ' ' ARG . 5.1 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.275 -0.869 . . . . 1.1 111.13 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.91 0.386 . . . . 5.27 110.864 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.45 HD22 ' N ' ' A' ' 4' ' ' SER . 3.0 p-10 -111.62 171.23 7.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 3.86 110.827 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -59.84 -49.97 75.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 1.79 110.48 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.45 ' N ' HD22 ' A' ' 2' ' ' ASN . 3.2 p -178.59 -70.31 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.024 -0.535 . . . . 1.99 111.102 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.696 ' HE1' ' HG2' ' A' ' 64' ' ' LYS . 0.4 OUTLIER 57.58 93.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.414 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.473 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 19.2 m120 -109.14 103.82 53.4 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.972 -0.558 . . . . 1.72 110.887 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.81 -12.37 4.6 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.19 1.927 . . . . 0.43 111.885 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.556 ' HE3' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -79.49 -54.2 6.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.943 -0.571 . . . . 1.39 110.602 179.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.6 m -76.76 -36.85 56.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.859 -0.609 . . . . 0.71 111.481 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 26' ' ' LEU . 68.8 mt -63.89 -11.22 25.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.5 111.098 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.548 HG21 ' CD2' ' A' ' 75' ' ' TYR . 15.9 p -125.73 20.79 7.77 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.532 -0.467 . . . . 0.35 111.437 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.05 113.85 56.57 Favored Pre-proline 0 N--CA 1.452 -0.342 0 N-CA-C 108.497 -0.927 . . . . 0.57 108.497 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.628 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 64.1 Cg_exo -44.4 -20.38 0.32 Allowed 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.265 1.977 . . . . 0.13 113.606 -178.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.481 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.16 -50.11 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.172 -0.677 . . . . 1.37 109.172 179.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -79.0 -40.14 32.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.372 -0.831 . . . . 0.12 110.69 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.709 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.3 mt -60.97 -33.96 74.02 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.384 -0.826 . . . . 0.27 111.635 -178.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.9 mttt -82.22 -23.4 35.42 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.905 -0.776 . . . . 0.88 108.905 177.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -117.47 65.57 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.916 -1.038 . . . . 0.53 108.921 178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.464 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 3.2 mm -40.47 -49.04 6.91 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.052 -0.522 . . . . 0.49 112.092 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' SER . 98.6 Cg_exo -47.12 -42.61 26.24 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 121.364 1.376 . . . . 0.15 110.779 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.49 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -72.28 -39.52 68.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.408 -1.269 . . . . 0.94 109.64 179.051 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.631 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.3 t90 -52.27 -37.83 56.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.679 -0.691 . . . . 0.11 109.846 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 32' ' ' SER . 77.2 mt -74.8 -26.59 59.84 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.279 -0.873 . . . . 0.13 110.904 178.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' MET . 0.1 OUTLIER -58.72 -39.1 79.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.236 -0.438 . . . . 3.29 110.442 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.9 t -76.47 -7.06 54.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.885 -0.598 . . . . 0.96 110.018 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.07 HD21 HD21 ' A' ' 10' ' ' LEU . 61.9 mt -112.75 -1.0 14.83 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.573 -0.739 . . . . 0.66 110.542 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 21.5 mmm180 68.13 9.66 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.605 -0.725 . . . . 4.34 111.395 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.597 HD22 HD11 ' A' ' 65' ' ' LEU . 1.1 mp -103.89 23.81 12.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.604 -0.271 . . . . 0.67 110.748 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.402 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 19.7 p-80 -60.08 -12.76 9.06 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 107.591 -1.263 . . . . 0.29 107.591 177.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' N ' ' C ' ' A' ' 28' ' ' LEU . 1.5 pttt -56.57 -37.45 70.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 113.549 -1.659 . . . . 0.72 108.872 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 56' ' ' VAL . 29.5 m-85 -104.07 27.15 7.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.572 -1.195 . . . . 0.28 110.557 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.683 ' HA ' HD12 ' A' ' 23' ' ' LEU . 4.0 m -63.95 -46.04 86.49 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.027 -0.533 . . . . 1.3 110.228 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.82 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.079 -0.51 . . . . 2.21 111.086 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 35' ' ' LEU . . . -67.58 -28.56 67.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.763 -0.653 . . . . 0.15 112.647 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 31' ' ' TYR . 1.6 mp -103.31 -7.55 21.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.568 0.581 . . . . 0.47 112.568 -177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 20' ' ' PRO . 44.8 t -68.81 -46.22 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.79 0.329 . . . . 0.95 110.647 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -54.99 -14.31 5.47 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.762 -0.732 . . . . 0.15 111.916 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.458 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.7 m -112.37 128.07 26.0 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 110.406 -0.22 . . . . 0.11 110.406 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 71.3 Cg_endo -69.08 178.11 4.47 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.634 2.222 . . . . 0.09 111.734 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.754 ' HZ3' ' HZ2' ' A' ' 76' ' ' LYS . 49.0 p-90 -69.97 -49.82 47.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.191 -0.604 . . . . 0.21 110.054 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -50.67 -24.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.377 -0.374 . . . . 0.45 111.324 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -98.21 -37.88 9.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.132 0.491 . . . . 2.15 109.679 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HA ' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -56.1 -62.11 1.93 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.394 -0.821 . . . . 0.11 109.241 178.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 40' ' ' TRP . 20.8 pt -53.67 -19.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.32 -1.309 . . . . 0.2 111.838 178.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.497 ' HE1' HG12 ' A' ' 73' ' ' ILE . 4.5 m-30 -97.36 -13.3 21.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 0.19 111.653 -179.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.821 HD22 HG21 ' A' ' 50' ' ' THR . 45.1 mt -62.71 -166.18 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.398 0.618 . . . . 0.14 110.925 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HA ' HD21 ' A' ' 66' ' ' LEU . 10.5 m-20 -149.52 169.33 21.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.131 -0.94 . . . . 1.31 109.607 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.528 ' H ' HD11 ' A' ' 66' ' ' LEU . 2.0 p-10 -48.59 -51.82 25.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.009 0.433 . . . . 1.73 110.271 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 35.7 tt0 -52.2 -60.43 3.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.681 -0.69 . . . . 0.52 111.101 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.873 HG22 ' HD3' ' A' ' 54' ' ' LYS . 62.5 m -49.2 -47.62 46.0 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.411 -0.359 . . . . 0.19 110.841 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.66 HD22 HG21 ' A' ' 56' ' ' VAL . 30.9 mt -51.53 -40.61 59.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.89 110.367 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HG3' ' HA ' ' A' ' 57' ' ' LEU . 16.7 tt0 -65.74 -38.14 88.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.623 0.725 . . . . 0.52 109.135 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 1.0 OUTLIER -64.1 -30.28 71.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.57 -1.195 . . . . 2.19 111.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.873 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -76.3 -55.91 5.12 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.601 0.715 . . . . 1.2 109.138 178.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.404 ' O ' HD13 ' A' ' 57' ' ' LEU . . . 172.95 -17.08 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 114.491 -1.231 . . . . 0.38 111.5 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.66 HG21 HD22 ' A' ' 51' ' ' LEU . 2.9 t -69.6 80.5 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 121.186 0.517 . . . . 0.89 110.119 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.525 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -78.89 -30.89 45.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.546 -0.752 . . . . 0.83 111.993 -178.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -59.29 110.47 1.09 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 116.376 -0.374 . . . . 0.21 111.801 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.543 HD13 ' HE ' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -52.51 -29.62 26.03 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.645 -0.872 . . . . 0.27 108.645 177.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.15 -40.13 35.23 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 114.899 -1.046 . . . . 0.14 112.869 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.77 -48.37 32.13 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.807 0.669 . . . . 0.16 112.807 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.614 ' HA ' HD13 ' A' ' 51' ' ' LEU . 16.0 ptt180 -68.21 -60.94 2.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 112.629 0.603 . . . . 0.81 112.629 -178.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.743 ' HA ' HD12 ' A' ' 66' ' ' LEU . 0.9 OUTLIER -51.7 -22.56 3.58 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.575 -0.528 . . . . 2.47 109.575 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.696 ' HG2' ' HE1' ' A' ' 5' ' ' MET . 3.8 ttmp? -79.08 -40.6 30.78 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.65 -0.705 . . . . 2.52 110.945 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.597 HD11 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -58.06 -25.71 61.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.021 0.439 . . . . 0.23 110.432 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.1 mt -61.78 -21.06 64.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.713 -0.676 . . . . 0.15 110.417 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.68 ' HE3' ' HG2' ' A' ' 5' ' ' MET . 0.2 OUTLIER -78.27 -38.8 41.84 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.659 -0.867 . . . . 2.2 108.659 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -73.5 -27.2 61.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.215 -0.902 . . . . 0.23 110.102 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.521 ' CD1' ' HA ' ' A' ' 44' ' ' ILE . 12.5 m-30 -62.34 -42.06 99.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.297 -0.865 . . . . 0.12 111.366 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.5 -43.67 29.52 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.947 -0.644 . . . . 0.13 113.94 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 68' ' ' ALA . 19.1 mt -54.19 -36.46 32.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.88 0.371 . . . . 0.25 110.86 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 68' ' ' ALA . 60.5 t -70.39 -46.15 72.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.261 0.553 . . . . 0.15 110.11 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.657 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 44.4 mt -52.97 -48.62 51.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.075 -0.966 . . . . 0.28 112.352 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.11 -60.1 3.64 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.771 0.656 . . . . 0.61 112.771 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.548 ' CD2' HG21 ' A' ' 11' ' ' THR . 1.5 m-30 -53.55 -32.51 51.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.587 0.708 . . . . 1.41 109.313 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.78 ' CB ' ' HZ3' ' A' ' 76' ' ' LYS . 1.6 ttmp? -64.42 -46.85 81.46 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.883 -1.053 . . . . 1.66 108.769 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 73' ' ' ILE . 22.9 mt-10 -70.32 -15.63 62.9 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.098 -1.41 . . . . 1.16 111.012 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 -99.75 23.53 9.52 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.023 -0.535 . . . . 2.37 110.533 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 p30 46.24 28.68 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 2.13 110.558 -178.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -88.18 -21.64 24.47 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.57 -0.741 . . . . 0.5 110.668 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.666 HD12 ' HB2' ' A' ' 76' ' ' LYS . 56.4 mt -97.99 136.59 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.176 -0.466 . . . . 0.18 110.426 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -60.93 129.64 42.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.203 -0.453 . . . . 0.47 109.985 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 37.9 mmm-85 -60.84 -12.68 11.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.207 -0.451 . . . . 1.48 110.568 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.3 t -68.24 -37.42 80.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 1.09 110.449 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.628 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -56.72 -43.51 80.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.09 0.471 . . . . 0.22 109.873 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.513 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 3.9 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.025 -0.989 . . . . 1.1 111.268 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.786 0.326 . . . . 5.27 110.98 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.469 HD21 ' HE ' ' A' ' 27' ' ' ARG . 3.6 p-10 -141.01 -176.96 4.87 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 3.86 110.886 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.476 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 77.4 p -150.42 72.49 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 1.79 110.703 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -85.72 131.8 34.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.99 110.981 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.576 ' HE2' ' HB2' ' A' ' 68' ' ' ALA . 0.5 OUTLIER -83.85 107.53 16.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.066 -0.515 . . . . 1.22 110.797 179.657 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.472 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 12.5 m120 -89.88 103.19 5.8 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 1.72 111.058 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 5' ' ' MET . 29.3 Cg_exo -59.98 -8.53 8.1 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.425 2.083 . . . . 0.43 112.495 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.48 -51.79 9.48 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.398 -0.593 . . . . 1.39 109.398 178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.551 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 6.3 m -77.3 -29.1 53.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.34 -0.846 . . . . 0.71 111.068 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.924 HD21 HD11 ' A' ' 26' ' ' LEU . 23.6 mt -71.4 -7.03 44.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.5 111.35 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.442 ' HB ' HG12 ' A' ' 81' ' ' ILE . 9.9 p -132.03 16.55 4.65 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.511 -0.476 . . . . 0.35 111.821 -179.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 33.4 t70 -109.93 110.66 58.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.182 -0.673 . . . . 0.57 109.182 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.5 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 66.4 Cg_exo -44.19 -20.18 0.28 Allowed 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.562 2.174 . . . . 0.13 113.898 -178.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -50.65 71.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.312 -0.625 . . . . 1.37 109.312 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.66 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.2 mm? -75.17 -47.97 25.84 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.468 -0.787 . . . . 0.12 110.35 178.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 40' ' ' TRP . 13.8 mt -50.52 -48.71 56.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.192 -0.913 . . . . 0.27 111.132 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 85' ' ' ALA . 61.4 mttm -68.42 -28.02 66.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.143 0.497 . . . . 0.88 110.169 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.423 ' ND2' ' HB2' ' A' ' 21' ' ' MET . 24.1 t30 -112.31 68.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.443 -0.798 . . . . 0.53 109.204 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 38' ' ' THR . 20.1 mm -39.89 -49.9 5.76 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.239 -0.437 . . . . 0.49 112.154 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' A' ' 36' ' ' SER . 93.8 Cg_exo -46.94 -45.35 21.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.516 1.477 . . . . 0.15 110.762 178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.477 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -69.26 -42.83 75.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.537 -1.21 . . . . 0.94 109.554 178.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.66 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 79.6 t90 -52.54 -36.9 56.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.412 -0.813 . . . . 0.11 110.164 177.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.647 HD12 ' HA ' ' A' ' 32' ' ' SER . 84.9 mt -76.25 -26.1 55.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.192 -0.913 . . . . 0.13 110.816 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.16 -39.08 69.09 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.472 -0.566 . . . . 3.29 109.472 178.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -73.38 -20.67 60.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.2 -0.667 . . . . 0.96 109.2 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.924 HD11 HD21 ' A' ' 10' ' ' LEU . 3.1 mp -98.3 4.6 48.7 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.209 -0.905 . . . . 0.66 111.057 178.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HD2' ' C ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER 57.39 7.66 0.52 Allowed 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.332 -1.304 . . . . 4.34 110.129 -178.337 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.684 HD12 ' HB3' ' A' ' 26' ' ' LEU . 15.3 mt -95.61 22.07 7.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.927 -0.579 . . . . 0.67 111.226 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -59.52 -13.38 8.86 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 107.409 -1.33 . . . . 0.29 107.409 177.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 28' ' ' LEU . 1.3 ptmt -59.31 -41.17 88.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.957 -1.474 . . . . 0.72 108.776 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CD1' ' HA ' ' A' ' 56' ' ' VAL . 19.6 m-85 -100.49 28.39 5.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.318 -1.31 . . . . 0.28 110.358 179.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.647 ' HA ' HD12 ' A' ' 23' ' ' LEU . 92.3 p -68.18 -48.18 65.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.534 -0.757 . . . . 1.3 110.064 179.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.05 -37.12 71.36 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.909 -0.587 . . . . 2.21 110.7 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -76.6 -39.19 53.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.519 -0.764 . . . . 0.15 112.549 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -93.37 -8.87 40.63 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.608 0.596 . . . . 0.47 112.608 -178.038 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.521 ' HB3' ' HG3' ' A' ' 20' ' ' PRO . 77.9 p -67.29 -44.34 79.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.791 0.329 . . . . 0.95 111.134 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.05 -12.41 5.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.781 -0.723 . . . . 0.15 112.279 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.62 ' O ' HG13 ' A' ' 19' ' ' ILE . 47.2 m -117.2 128.96 25.67 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.929 -0.136 . . . . 0.11 110.65 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.49 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 61.1 Cg_endo -68.4 -179.65 2.44 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.909 2.406 . . . . 0.09 111.894 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.635 ' O ' HG12 ' A' ' 44' ' ' ILE . 45.0 p-90 -72.35 -49.52 33.61 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 120.501 -0.48 . . . . 0.21 110.115 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.408 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.4 OUTLIER -50.01 -25.13 2.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.842 0.353 . . . . 0.45 110.816 -179.544 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -98.45 -37.79 9.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.511 -0.552 . . . . 2.15 109.511 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.612 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -56.59 -58.74 6.76 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.446 -0.797 . . . . 0.11 109.123 178.469 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.639 HG21 HG11 ' A' ' 72' ' ' VAL . 21.9 pt -58.29 -10.34 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.347 -1.297 . . . . 0.2 111.35 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.457 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.3 m-30 -106.71 -12.32 15.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.19 111.463 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.94 HD22 HG21 ' A' ' 50' ' ' THR . 49.5 mt -63.78 -164.45 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.383 0.611 . . . . 0.14 110.753 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.506 ' HA ' HD21 ' A' ' 66' ' ' LEU . 12.8 m-20 -154.18 173.58 15.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.227 -0.897 . . . . 1.31 110.035 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.503 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -48.02 -51.5 23.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.196 0.522 . . . . 1.73 110.038 179.133 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 38.7 tt0 -55.11 -59.44 4.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.507 -0.769 . . . . 0.52 111.757 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.94 HG21 HD22 ' A' ' 46' ' ' LEU . 43.6 m -49.17 -49.81 40.76 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 116.62 -0.263 . . . . 0.19 111.567 -178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.733 HD22 HD13 ' A' ' 65' ' ' LEU . 17.6 mt -50.59 -37.25 39.01 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.361 0.413 . . . . 0.89 110.665 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.539 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 19.3 tt0 -69.51 -39.24 77.7 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.804 -0.813 . . . . 0.52 108.804 178.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 3.9 mmmm -63.67 -26.19 68.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.407 -1.27 . . . . 2.19 110.86 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.917 ' HD3' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -75.15 -65.19 0.91 Allowed 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.527 0.679 . . . . 1.2 109.662 179.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.419 ' O ' HD22 ' A' ' 57' ' ' LEU . . . 167.5 14.51 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 114.732 -1.122 . . . . 0.38 112.421 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.769 HG12 ' H ' ' A' ' 58' ' ' ALA . 50.2 t -65.88 -68.14 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.334 0.588 . . . . 0.89 109.802 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER 66.28 26.64 10.33 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.944 -1.026 . . . . 0.83 112.571 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -131.41 104.79 7.2 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.042 -0.263 . . . . 0.21 111.241 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.434 ' CD1' HH21 ' A' ' 62' ' ' ARG . 4.4 mm? -49.84 -29.51 8.16 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.886 -0.783 . . . . 0.27 108.886 178.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.53 ' O ' ' HB2' ' A' ' 64' ' ' LYS . . . -75.38 -42.07 28.82 Favored Glycine 0 N--CA 1.44 -1.065 0 CA-C-N 115.021 -0.99 . . . . 0.14 112.384 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -74.51 -54.78 6.86 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 113.461 0.911 . . . . 0.16 113.461 -179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.73 ' HA ' HD13 ' A' ' 51' ' ' LEU . 13.3 ptt180 -63.13 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.785 0.661 . . . . 0.81 112.785 -177.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.698 ' HA ' HD12 ' A' ' 66' ' ' LEU . 74.6 mtp180 -49.62 -25.77 3.1 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.273 0.559 . . . . 2.47 109.61 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 11.3 tppt? -79.48 -42.34 25.48 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.373 -0.83 . . . . 2.52 111.025 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.733 HD13 HD22 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -56.07 -24.55 40.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.23 110.461 179.519 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 63' ' ' ARG . 3.3 mt -61.75 -20.61 63.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.811 -0.631 . . . . 0.15 110.091 179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -77.7 -38.51 47.19 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.054 -0.721 . . . . 2.2 109.054 178.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.617 ' HB2' HD21 ' A' ' 26' ' ' LEU . . . -71.37 -34.83 70.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.144 -0.935 . . . . 0.23 110.046 179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.536 ' HE1' HD12 ' A' ' 43' ' ' LEU . 17.6 m-30 -58.79 -38.99 79.77 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.12 110.564 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.7 -49.63 10.47 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 121.031 -0.604 . . . . 0.13 113.829 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 17.0 mt -54.07 -36.29 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.941 0.371 . . . . 0.25 110.518 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.705 HG22 ' HB3' ' A' ' 10' ' ' LEU . 62.8 t -71.35 -45.76 68.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 0.15 110.041 179.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.539 ' CG1' HD12 ' A' ' 44' ' ' ILE . 31.6 mt -56.35 -57.71 7.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.497 -0.774 . . . . 0.28 111.801 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' GLU . 8.5 t70 -51.57 -55.51 18.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.493 -0.322 . . . . 0.61 111.15 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.553 ' CD1' HD22 ' A' ' 80' ' ' LEU . 16.2 m-85 -60.11 -31.84 70.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.672 -0.492 . . . . 1.41 109.672 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.647 ' HB2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -68.97 -33.52 73.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.374 -0.972 . . . . 1.66 108.374 177.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 1.5 mm-40 -74.95 -27.82 60.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.79 -1.096 . . . . 1.16 110.858 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -90.65 13.48 15.92 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.922 -0.581 . . . . 2.37 111.222 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.3 t70 57.98 24.8 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 2.13 110.354 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.553 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -81.16 -10.56 59.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.766 -0.652 . . . . 0.5 110.547 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.647 HD12 ' HB2' ' A' ' 76' ' ' LYS . 89.4 mt -110.27 134.47 52.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.626 -0.715 . . . . 0.18 110.122 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.495 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 5.2 t70 -58.12 134.92 56.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.307 -0.406 . . . . 0.47 110.663 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.483 ' HA ' ' CD1' ' A' ' 86' ' ' TYR . 24.3 mmt85 -62.59 -12.96 26.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.998 -0.546 . . . . 1.48 110.502 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 72.5 m -64.9 -40.61 95.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.13 -0.486 . . . . 1.09 109.748 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.5 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -59.38 -45.65 90.86 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.803 -0.635 . . . . 0.22 110.069 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.497 ' HD1' ' H ' ' A' ' 86' ' ' TYR . 4.1 m-85 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.257 -0.878 . . . . 1.1 111.193 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.796 0.331 . . . . 5.27 110.938 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.511 ' H ' ' HG2' ' A' ' 27' ' ' ARG . 66.1 t30 -135.24 23.99 3.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 3.86 110.864 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.486 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 71.7 p -86.52 74.72 9.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 1.79 110.752 179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.2 m -85.69 1.91 47.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 1.99 111.186 -179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.582 ' HG2' ' HE2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER 56.74 61.84 2.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.999 -0.546 . . . . 1.22 110.913 -179.709 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.519 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 14.6 m120 -57.43 107.44 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 1.72 111.286 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.723 ' HG2' ' HE2' ' A' ' 8' ' ' LYS . 29.2 Cg_endo -64.5 -7.21 13.72 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.049 1.832 . . . . 0.43 111.998 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.723 ' HE2' ' HG2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -79.63 -48.22 14.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.339 0.59 . . . . 1.39 109.47 178.371 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.529 ' HB3' ' HG ' ' A' ' 15' ' ' LEU . 58.7 m -77.02 -40.2 47.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.229 -0.896 . . . . 0.71 111.291 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 26' ' ' LEU . 49.6 mt -62.32 -8.51 6.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 0.5 111.578 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.532 ' HB ' HG12 ' A' ' 81' ' ' ILE . 6.8 p -128.2 17.89 6.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.402 -0.519 . . . . 0.35 111.44 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 31.8 t70 -110.21 110.67 58.32 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.126 -0.694 . . . . 0.57 109.126 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.582 ' HG3' ' HB2' ' A' ' 85' ' ' ALA . 59.9 Cg_exo -43.89 -20.01 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.51 2.14 . . . . 0.13 113.787 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.451 ' HB3' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.53 -52.66 64.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.979 -0.748 . . . . 1.37 108.979 178.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.699 ' HB3' ' HA ' ' A' ' 22' ' ' TRP . 3.3 mm? -74.37 -47.74 32.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.445 -0.798 . . . . 0.12 110.283 178.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.563 HD21 ' O ' ' A' ' 10' ' ' LEU . 15.6 mt -50.7 -50.62 54.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.122 -0.944 . . . . 0.27 111.628 -178.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HE3' ' HB3' ' A' ' 13' ' ' PRO . 94.3 mttt -68.19 -24.96 65.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.139 0.495 . . . . 0.88 110.039 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.511 HD22 ' H ' ' A' ' 21' ' ' MET . 0.8 OUTLIER -113.39 67.4 0.67 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.525 -0.762 . . . . 0.53 109.225 179.728 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.563 HD11 ' CA ' ' A' ' 40' ' ' TRP . 12.9 mm -39.14 -49.15 4.39 Favored Pre-proline 0 CA--C 1.529 0.168 0 N-CA-C 111.764 0.283 . . . . 0.49 111.764 -178.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.425 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 80.1 Cg_exo -46.9 -48.27 14.68 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 121.647 1.565 . . . . 0.15 110.983 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.511 ' H ' HD22 ' A' ' 18' ' ' ASN . 0.0 OUTLIER -68.64 -41.55 79.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.724 -1.126 . . . . 0.94 109.857 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.699 ' HA ' ' HB3' ' A' ' 15' ' ' LEU . 76.0 t90 -52.6 -37.54 58.37 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.771 -0.65 . . . . 0.11 110.309 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 32' ' ' SER . 79.4 mt -74.26 -26.73 60.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.383 -0.826 . . . . 0.13 111.042 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -55.63 -42.27 74.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.823 0.344 . . . . 3.29 110.224 179.335 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.0 m -71.25 -14.03 62.1 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.167 0.508 . . . . 0.96 110.001 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HD21 ' A' ' 10' ' ' LEU . 20.0 mt -112.02 16.55 20.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.6 -0.727 . . . . 0.66 110.009 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.511 ' HG2' ' H ' ' A' ' 2' ' ' ASN . 0.4 OUTLIER 45.4 18.93 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.306 -0.861 . . . . 4.34 112.305 -179.264 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.882 HD23 ' HE3' ' A' ' 30' ' ' LYS . 5.6 mt -105.01 21.79 16.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.545 -0.298 . . . . 0.67 110.273 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.514 ' HA ' ' OG ' ' A' ' 32' ' ' SER . 27.8 p-80 -60.47 -15.03 22.95 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.257 -1.386 . . . . 0.29 107.257 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.882 ' HE3' HD23 ' A' ' 28' ' ' LEU . 3.9 pttt -58.69 -34.82 71.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.284 -1.78 . . . . 0.72 109.093 177.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.61 ' CD2' HG13 ' A' ' 56' ' ' VAL . 32.6 m-85 -104.63 19.11 20.98 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.165 -1.38 . . . . 0.28 110.752 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.686 ' HA ' HD12 ' A' ' 23' ' ' LEU . 9.9 m -59.54 -45.26 92.32 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.061 -0.518 . . . . 1.3 110.171 179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.61 -40.93 84.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.019 -0.537 . . . . 2.21 111.29 179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 54' ' ' LYS . . . -78.82 -24.04 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.998 -0.546 . . . . 0.15 112.452 -179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.649 ' HG ' HD11 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -106.3 -8.06 17.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.527 0.566 . . . . 0.47 112.527 -178.18 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 32' ' ' SER . 42.2 t -67.77 -46.49 71.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.711 0.291 . . . . 0.95 111.041 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -53.68 -13.81 3.32 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.884 -0.674 . . . . 0.15 112.26 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.553 ' O ' HG13 ' A' ' 19' ' ' ILE . 33.2 m -115.13 128.3 26.06 Favored Pre-proline 0 N--CA 1.451 -0.399 0 N-CA-C 110.651 -0.129 . . . . 0.11 110.651 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.471 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 62.0 Cg_endo -68.19 -179.54 2.29 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.761 2.308 . . . . 0.09 111.501 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.708 ' HZ3' ' HZ1' ' A' ' 76' ' ' LYS . 46.5 p-90 -72.58 -49.49 31.98 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.287 -0.565 . . . . 0.21 110.257 179.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.47 -25.28 2.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.761 0.315 . . . . 0.45 110.97 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -97.5 -36.82 10.2 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.607 -0.516 . . . . 2.15 109.607 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -57.02 -58.65 7.26 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.705 -0.85 . . . . 0.11 108.705 178.212 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 40' ' ' TRP . 16.1 pt -53.42 -15.51 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.988 -1.46 . . . . 0.2 111.604 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CD1' HG13 ' A' ' 44' ' ' ILE . 4.5 m-30 -102.05 -14.68 17.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.31 -0.405 . . . . 0.19 111.723 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.922 HD22 HG21 ' A' ' 50' ' ' THR . 41.5 mt -62.55 -167.37 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 121.346 0.594 . . . . 0.14 110.463 178.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.52 ' HA ' HD21 ' A' ' 66' ' ' LEU . 14.0 m-20 -153.7 170.69 20.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.271 -0.877 . . . . 1.31 109.633 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.695 ' H ' HD11 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -47.72 -47.43 30.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.593 -0.521 . . . . 1.73 109.593 179.022 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 53' ' ' LYS . 40.6 tt0 -52.87 -64.2 0.9 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.781 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.922 HG21 HD22 ' A' ' 46' ' ' LEU . 93.3 m -48.9 -50.73 33.65 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 116.211 -0.449 . . . . 0.19 111.356 -179.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 56' ' ' VAL . 42.8 mt -50.86 -41.18 57.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 0.89 110.12 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.525 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 26.7 tt0 -63.87 -43.37 96.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.822 0.82 . . . . 0.52 108.983 178.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 4.3 mmmm -58.04 -33.87 69.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.294 -1.321 . . . . 2.19 111.143 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 50' ' ' THR . 1.3 mmmt -74.61 -56.7 4.53 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.485 0.659 . . . . 1.2 109.766 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.78 -16.68 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.82 -1.082 . . . . 0.38 111.68 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.643 ' HB ' ' HB3' ' A' ' 51' ' ' LEU . 2.8 t -70.83 77.57 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.565 -0.532 . . . . 0.89 109.565 178.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -78.43 -33.14 48.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.428 -0.805 . . . . 0.83 112.298 -178.142 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . . . -54.29 109.06 0.44 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.565 -0.289 . . . . 0.21 111.714 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.42 ' CD2' HH21 ' A' ' 62' ' ' ARG . 4.5 mm? -51.72 -28.16 14.11 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.639 -0.875 . . . . 0.27 108.639 178.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.65 -41.43 29.25 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 114.918 -1.037 . . . . 0.14 112.606 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 58' ' ' ALA . . . -73.7 -52.58 12.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.049 0.759 . . . . 0.16 113.049 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 48' ' ' ASP . 25.7 ptt180 -66.16 -59.98 3.24 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.484 0.55 . . . . 0.81 112.484 -178.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.714 ' HA ' HD12 ' A' ' 66' ' ' LEU . 76.5 mtp180 -49.64 -24.05 2.02 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.981 -0.377 . . . . 2.47 109.981 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.462 ' HE3' ' HE1' ' A' ' 5' ' ' MET . 14.0 mmmt -76.92 -42.64 38.62 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.122 -0.49 . . . . 2.52 110.713 179.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.578 ' HG ' HD13 ' A' ' 28' ' ' LEU . 0.3 OUTLIER -55.48 -29.74 59.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.23 110.507 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.714 HD12 ' HA ' ' A' ' 63' ' ' ARG . 2.9 mt -57.89 -25.08 60.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.827 -0.624 . . . . 0.15 110.321 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.582 ' HE2' ' HG2' ' A' ' 5' ' ' MET . 2.1 tmmm? -78.69 -37.05 42.65 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.746 -0.835 . . . . 2.2 108.746 179.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.662 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -72.64 -23.9 60.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.017 -0.992 . . . . 0.23 110.237 178.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.526 ' HE1' HD12 ' A' ' 43' ' ' LEU . 16.6 m-30 -69.6 -40.74 76.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.63 -0.714 . . . . 0.12 111.583 -179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -74.1 -44.82 28.14 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.798 -0.715 . . . . 0.13 113.842 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD11 ' HD2' ' A' ' 67' ' ' LYS . 19.4 mt -54.15 -36.84 33.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.893 0.378 . . . . 0.25 110.951 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 68' ' ' ALA . 48.4 t -70.76 -43.57 77.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.266 0.555 . . . . 0.15 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.63 ' CG1' HD12 ' A' ' 44' ' ' ILE . 53.0 mt -59.13 -55.78 21.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.261 -0.881 . . . . 0.28 112.141 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.2 -55.75 29.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.36 -0.382 . . . . 0.61 111.353 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.56 ' CD1' HD22 ' A' ' 80' ' ' LEU . 12.5 m-85 -56.91 -32.76 66.24 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.939 0.4 . . . . 1.41 109.983 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.708 ' HZ1' ' HZ3' ' A' ' 40' ' ' TRP . 0.1 OUTLIER -63.35 -47.39 82.33 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.11 -1.07 . . . . 1.66 108.11 176.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -67.6 -16.63 64.27 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.507 -1.679 . . . . 1.16 111.479 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -98.33 14.35 28.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.426 -0.352 . . . . 2.37 110.858 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 59.77 28.27 17.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.332 0.587 . . . . 2.13 110.138 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.56 HD22 ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -91.37 -17.97 25.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.556 -0.747 . . . . 0.5 111.184 -179.687 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.626 HD12 ' HB2' ' A' ' 76' ' ' LYS . 60.6 mt -105.06 132.17 52.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.18 110.342 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.457 ' HB3' ' HG2' ' A' ' 13' ' ' PRO . 1.6 t70 -61.5 134.28 56.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 0.47 110.891 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -61.88 -13.44 24.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.975 -0.557 . . . . 1.48 110.414 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.2 t -67.52 -29.0 68.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.04 -0.527 . . . . 1.09 110.089 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.582 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . . . -71.2 -42.84 68.46 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.176 0.512 . . . . 0.22 109.837 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.441 ' OH ' ' HG3' ' A' ' 76' ' ' LYS . 2.3 m-85 . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.026 -0.988 . . . . 1.1 111.388 179.842 . . . . . . . . 1 1 . 1 stop_ save_