data_1cww_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 1cww _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.792 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 30.0 ttm . . . . . 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.812 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.4 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 2' ' ' ASP . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.693 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.839 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.683 ' HA ' HD11 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.487 ' C ' ' H ' ' A' ' 14' ' ' GLU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.714 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.487 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.425 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.854 ' HG ' HD13 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.627 ' HA ' ' NZ ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.854 HD13 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.756 ' HA ' HD21 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.655 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.641 HD12 HD23 ' A' ' 75' ' ' LEU . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.59 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.59 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.649 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.752 HD13 ' HE3' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.528 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.709 HE21 ' HB1' ' A' ' 53' ' ' ALA . 1.7 tp60 -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.507 HE21 ' HG3' ' A' ' 51' ' ' GLN . 27.4 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HG3' HE21 ' A' ' 50' ' ' GLN . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.634 ' HG2' HG23 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.709 ' HB1' HE21 ' A' ' 49' ' ' GLN . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.663 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.87 HD11 ' HE2' ' A' ' 59' ' ' MET . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.622 HG13 ' O ' ' A' ' 53' ' ' ALA . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.594 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.87 ' HE2' HD11 ' A' ' 56' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.495 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.664 ' O ' HG22 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.715 ' HA ' ' HD1' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.792 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.664 HG22 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.726 ' HE2' HD12 ' A' ' 9' ' ' LEU . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.641 HD23 HD12 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.663 ' HD2' ' CD1' ' A' ' 80' ' ' TYR . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.509 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.839 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.795 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 87' ' ' LEU . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.762 ' HE3' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm . . . . . 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.991 ' HB3' ' HE1' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.977 ' HA ' HD12 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.542 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.3 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 20' ' ' ILE . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.927 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.927 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.635 ' HA ' HD21 ' A' ' 56' ' ' LEU . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.572 ' H ' HG21 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.622 ' HD1' ' CD2' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.953 HG23 ' HB3' ' A' ' 74' ' ' ALA . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.751 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.751 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.63 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.518 ' O ' HG21 ' A' ' 30' ' ' ILE . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.464 ' O ' HG22 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.631 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.643 ' HB ' ' HE2' ' A' ' 26' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.418 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.719 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' A' ' 55' ' ' MET . 49.2 tp60 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.711 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.604 ' O ' ' HG3' ' A' ' 59' ' ' MET . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.664 HD13 ' HE2' ' A' ' 59' ' ' MET . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.711 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.664 ' HE2' HD13 ' A' ' 56' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.624 ' O ' ' HE1' ' A' ' 1' ' ' MET . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.442 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.477 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 68' ' ' TYR . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.424 HG22 ' HD2' ' A' ' 92' ' ' PRO . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.667 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.953 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.709 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.664 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.613 ' HA ' HD11 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.613 HD11 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.977 HD12 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.485 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.419 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.579 HG21 ' HD2' ' A' ' 92' ' ' PRO . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.579 ' HD2' HG21 ' A' ' 91' ' ' ILE . 90.4 Cg_exo . . . . . 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.817 ' HE2' HG22 ' A' ' 60' ' ' ILE . 32.8 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.531 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.531 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.608 ' HB1' ' HA3' ' A' ' 90' ' ' GLY . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.625 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.866 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.541 ' HA ' HD11 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.422 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.1 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.621 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.445 ' HZ1' ' CG ' ' A' ' 19' ' ' ASP . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 18' ' ' LYS . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.679 HD13 HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.435 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.849 HD13 HD21 ' A' ' 75' ' ' LEU . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.785 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.557 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.697 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.697 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.654 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.435 HD22 ' HE3' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.508 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.46 HG13 ' HB2' ' A' ' 56' ' ' LEU . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.508 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HA ' ' HB2' ' A' ' 54' ' ' ALA . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.788 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.567 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.763 HD13 ' HE3' ' A' ' 59' ' ' MET . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.788 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.763 ' HE3' HD13 ' A' ' 56' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.817 HG22 ' HE2' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.49 ' O ' HD21 ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.867 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.867 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.456 ' CG ' HD13 ' A' ' 60' ' ' ILE . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB1' ' CG2' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.849 HD21 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.644 ' HD2' ' CD1' ' A' ' 80' ' ' TYR . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.454 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.447 ' HA ' HD11 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.447 HD11 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.866 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.608 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.673 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.523 ' HE3' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.467 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.786 ' HB2' ' HE1' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.523 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.988 ' HA ' HD23 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.848 HD23 HG22 ' A' ' 57' ' ' ILE . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.599 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.599 ' CB ' ' HA ' ' A' ' 13' ' ' ARG . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.821 HD11 HG12 ' A' ' 57' ' ' ILE . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HB3' HD11 ' A' ' 25' ' ' ILE . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.59 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' A' ' 21' ' ' LYS . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.796 ' HB2' HD12 ' A' ' 56' ' ' LEU . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.655 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.412 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.805 HD12 ' HB2' ' A' ' 40' ' ' GLU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.623 ' HE1' ' CE2' ' A' ' 34' ' ' PHE . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.432 HG22 ' O ' ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.805 ' HB2' HD12 ' A' ' 30' ' ' ILE . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.642 HG21 ' HG3' ' A' ' 55' ' ' MET . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.472 HD21 ' HA ' ' A' ' 45' ' ' ASN . 2.9 m120 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.592 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 53' ' ' ALA . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 2.9 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.782 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.514 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.647 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.796 HD12 ' HB2' ' A' ' 26' ' ' MET . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.848 HG22 HD23 ' A' ' 10' ' ' LEU . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.701 ' HE1' HD11 ' A' ' 56' ' ' LEU . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 60' ' ' ILE . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.867 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.579 ' O ' HG21 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.634 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.579 HG21 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.652 ' HE2' ' CE1' ' A' ' 71' ' ' PHE . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.593 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.417 ' N ' HD11 ' A' ' 76' ' ' LEU . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.484 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.631 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.988 HD23 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.59 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.56 HD13 ' O ' ' A' ' 87' ' ' LEU . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo . . . . . 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.501 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.624 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.954 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.518 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.447 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 37.7 m-70 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.518 ' H ' ' C ' ' A' ' 11' ' ' GLN . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.645 HD13 HD13 ' A' ' 20' ' ' ILE . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.704 ' HA ' HG21 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.704 HG21 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.628 ' HA ' HD21 ' A' ' 56' ' ' LEU . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.495 ' H ' ' CG2' ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 74' ' ' ALA . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.699 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.528 ' HB3' HD11 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.699 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.654 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.758 HD22 ' HE2' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HB3' ' HE2' ' A' ' 55' ' ' MET . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.616 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.688 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.701 HE21 ' HG3' ' A' ' 51' ' ' GLN . 16.5 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.701 ' HG3' HE21 ' A' ' 50' ' ' GLN . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.688 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.707 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.729 ' HA ' HD13 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.701 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.636 HD12 ' HB2' ' A' ' 26' ' ' MET . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.729 HD13 ' HA ' ' A' ' 54' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.758 ' HE2' HD22 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 60' ' ' ILE . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.424 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.654 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.645 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 72' ' ' TYR . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.634 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.608 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.595 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.594 HD11 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.954 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.54 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.4 t-160 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.579 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.54 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.722 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm . . . . . 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.683 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.631 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 1.131 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.637 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.864 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.438 ' N ' HD12 ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.697 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.467 ' CG2' ' H ' ' A' ' 23' ' ' SER . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.467 ' H ' ' CG2' ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.547 HD11 HD21 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.74 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.674 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.74 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.674 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.511 HD11 ' HE3' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.68 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.64 ' HB2' HD12 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.774 HG21 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.526 HD21 ' HA ' ' A' ' 45' ' ' ASN . 0.3 OUTLIER -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.733 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HG2' ' HB1' ' A' ' 53' ' ' ALA . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.733 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HG2' ' CG2' ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.709 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.774 ' HG3' HG21 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.851 HD12 ' HE2' ' A' ' 59' ' ' MET . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.709 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.851 ' HE2' HD12 ' A' ' 56' ' ' LEU . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.494 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.575 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.572 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.722 ' HB2' ' HE2' ' A' ' 1' ' ' MET . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.499 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 80' ' ' TYR . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.551 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.58 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 1.131 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.662 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.481 ' HE3' HG23 ' A' ' 60' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.526 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.991 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HA ' HD12 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.745 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.627 ' HB1' HD23 ' A' ' 83' ' ' LEU . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.745 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.526 HG13 ' HA ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.478 ' HB ' ' HA ' ' A' ' 53' ' ' ALA . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 74' ' ' ALA . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.698 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.421 ' HB3' HD12 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.411 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.572 HD11 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.466 ' O ' HG21 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.548 HG22 ' CG ' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HG2' ' HB3' ' A' ' 53' ' ' ALA . 6.6 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 28.7 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.611 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' HG2' ' A' ' 49' ' ' GLN . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.689 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.893 HD11 ' HE3' ' A' ' 59' ' ' MET . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.656 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.893 ' HE3' HD11 ' A' ' 56' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.499 ' H ' HD11 ' A' ' 60' ' ' ILE . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 61' ' ' LEU . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.609 ' HG3' ' HG ' ' A' ' 67' ' ' SER . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.48 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG22 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.609 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.637 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.596 ' HE2' ' CE1' ' A' ' 71' ' ' PHE . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.6 ' CE1' ' HB2' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.775 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.462 HD12 ' HB1' ' A' ' 84' ' ' ALA . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.692 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.6 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.991 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.546 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.519 HD11 ' CE2' ' A' ' 68' ' ' TYR . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo . . . . . 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.774 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 30.3 ttm . . . . . 0 N--CA 1.444 -0.757 0 CA-C-O 120.861 0.362 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.747 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' HB3' ' A' ' 2' ' ' ASP . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.637 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' HD21 ' A' ' 16' ' ' LEU . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.544 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.8 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.444 ' O ' ' HD2' ' A' ' 18' ' ' LYS . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.495 ' N ' HD11 ' A' ' 16' ' ' LEU . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.653 HG23 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.935 HG23 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.742 ' H ' HG21 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 1.026 HG23 ' HB3' ' A' ' 74' ' ' ALA . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.756 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.581 ' HE2' HD13 ' A' ' 35' ' ' LEU . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 29' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.616 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 1.0 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 0.7 OUTLIER -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.935 ' HG2' HG23 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.688 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.644 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.78 HD11 ' HE2' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.688 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.78 ' HE2' HD11 ' A' ' 56' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.654 ' O ' ' HE2' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.635 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.89 ' HH ' ' HB3' ' A' ' 87' ' ' LEU . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD12 ' A' ' 9' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.515 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 1.026 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.904 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.543 ' CD2' HD13 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.904 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.574 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.515 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.89 ' HB3' ' HH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.895 ' HE2' ' H ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 1.0 ' HB2' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.721 ' HD3' ' HE1' ' A' ' 1' ' ' MET . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.558 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.69 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.91 ' HA ' HD23 ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.558 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.502 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.522 ' HB3' ' CD2' ' A' ' 83' ' ' LEU . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.826 HD21 HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HA ' HG21 ' A' ' 20' ' ' ILE . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.826 HD12 HD21 ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.679 HG22 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG22 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.607 ' HD2' ' CD1' ' A' ' 24' ' ' TYR . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.76 HG23 ' HB3' ' A' ' 74' ' ' ALA . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.665 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.501 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.469 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.665 HG13 ' O ' ' A' ' 26' ' ' MET . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HB3' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.668 ' HE2' ' CE1' ' A' ' 34' ' ' PHE . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.469 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.562 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.626 HE21 ' HG2' ' A' ' 51' ' ' GLN . 32.4 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.626 ' HG2' HE21 ' A' ' 50' ' ' GLN . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.734 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.611 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.977 HD12 ' HE1' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.448 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.977 ' HE1' HD12 ' A' ' 56' ' ' LEU . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.645 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.448 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.475 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.612 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.498 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.0 ' HE2' ' HB2' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.547 HG21 HG21 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.489 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.405 ' HE2' HD12 ' A' ' 9' ' ' LEU . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.452 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.76 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.53 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.91 HD23 ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.551 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.547 HG21 HG21 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo . . . . . 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.705 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.98 ' HB1' ' HE1' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HB2' ' CG ' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.507 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD12 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' HD12 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.441 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.711 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.869 ' HG ' HD11 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.51 ' N ' HD21 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.869 HD11 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.645 ' HB ' ' HA ' ' A' ' 53' ' ' ALA . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.583 HD13 HD22 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.556 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.533 ' HE3' HD13 ' A' ' 35' ' ' LEU . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.556 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.65 ' HE2' ' CE1' ' A' ' 34' ' ' PHE . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.533 HD13 ' HE3' ' A' ' 29' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.708 ' HB2' HD12 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.442 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.759 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.711 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 98.9 mm-40 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 48' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.759 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.805 HD13 ' HE2' ' A' ' 59' ' ' MET . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.737 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.805 ' HE2' HD13 ' A' ' 56' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.649 HG23 ' HE2' ' A' ' 1' ' ' MET . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.472 ' O ' HD23 ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 59' ' ' MET . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.514 ' N ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.562 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.665 ' HE1' ' CE2' ' A' ' 68' ' ' TYR . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.414 ' CD2' ' HB2' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.583 HD22 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.618 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.58 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.414 ' HB2' ' CD2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.523 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.564 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 24.5 ttm . . . . . 0 N--CA 1.432 -1.326 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.788 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 1.034 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.779 ' HA ' HD12 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.573 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.573 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.944 HD11 HD13 ' A' ' 20' ' ' ILE . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.944 HD13 HD11 ' A' ' 16' ' ' LEU . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.538 ' HA ' HD21 ' A' ' 56' ' ' LEU . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 24' ' ' TYR . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.683 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.496 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.759 HG12 ' O ' ' A' ' 26' ' ' MET . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.595 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.729 HD12 ' HE3' ' A' ' 59' ' ' MET . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.621 HD13 ' H ' ' A' ' 37' ' ' ILE . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.555 HG23 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.817 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.866 HE21 ' HG3' ' A' ' 51' ' ' GLN . 14.4 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.866 ' HG3' HE21 ' A' ' 50' ' ' GLN . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.817 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.631 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.579 HD12 ' HE2' ' A' ' 59' ' ' MET . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.751 HG12 HG23 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.729 ' HE3' HD12 ' A' ' 35' ' ' LEU . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.554 ' O ' ' HE2' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.671 ' O ' HG22 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.595 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.626 ' HD1' ' CD2' ' A' ' 68' ' ' TYR . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.671 HG22 ' O ' ' A' ' 65' ' ' ASN . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.645 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.659 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.447 ' CB ' HG21 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.683 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.828 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.828 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.56 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.596 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.56 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.546 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.1 t-160 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.546 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.751 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.664 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.654 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.954 ' HA ' HD12 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 13' ' ' ARG . 3.4 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.811 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.811 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.575 ' HA ' HG21 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.575 HG21 ' HA ' ' A' ' 17' ' ' GLU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.754 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.439 ' H ' ' CG2' ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.643 ' HE2' ' CE1' ' A' ' 24' ' ' TYR . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.616 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.822 ' HE2' HD13 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.757 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.822 HD13 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.526 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.808 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.975 HD23 ' HE2' ' A' ' 59' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.627 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.593 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.524 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.581 HE21 ' HG3' ' A' ' 51' ' ' GLN . 19.0 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.581 ' HG3' HE21 ' A' ' 50' ' ' GLN . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.549 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.632 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.754 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.662 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.975 ' HE2' HD23 ' A' ' 35' ' ' LEU . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.483 HG21 ' HE2' ' A' ' 1' ' ' MET . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 10' ' ' LEU . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG3' ' HG ' ' A' ' 67' ' ' SER . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.495 ' N ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.808 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.751 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.667 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.545 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.616 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.45 ' O ' ' HB1' ' A' ' 85' ' ' ALA . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.641 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 81' ' ' LYS . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.954 HD12 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.441 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.642 HD11 ' CE2' ' A' ' 68' ' ' TYR . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.599 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 5' ' ' ALA . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' A' ' 2' ' ' ASP . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.599 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.785 HD12 ' HE1' ' A' ' 71' ' ' PHE . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.669 HD11 ' HG ' ' A' ' 61' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.673 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.4 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.866 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.977 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.977 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.668 ' HB2' ' HE1' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.426 ' H ' HG22 ' A' ' 22' ' ' THR . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.407 ' H ' ' CG2' ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.626 ' HD2' ' CD1' ' A' ' 24' ' ' TYR . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.906 HD12 HD21 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.757 ' HE3' ' HB ' ' A' ' 43' ' ' VAL . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.735 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.711 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.628 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.735 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.757 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.971 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.962 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.971 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.962 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.587 ' HB2' ' HG2' ' A' ' 49' ' ' GLN . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.614 ' HG3' HG23 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.781 HD11 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.511 ' CD1' HG23 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.781 ' HE1' HD11 ' A' ' 56' ' ' LEU . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 10' ' ' LEU . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.632 ' O ' HG21 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.653 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.632 HG21 ' O ' ' A' ' 65' ' ' ASN . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.645 ' HE1' ' CE2' ' A' ' 71' ' ' PHE . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.666 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.906 HD21 HD12 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.416 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HA ' ' HG ' ' A' ' 87' ' ' LEU . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.724 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.547 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.628 HG23 HG22 ' A' ' 69' ' ' VAL . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo . . . . . 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.532 ' CG ' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.552 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.835 ' HB3' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.556 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.938 ' HA ' HD22 ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.726 HD21 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.413 ' C ' ' H ' ' A' ' 13' ' ' ARG . 6.3 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.928 HD23 HD13 ' A' ' 20' ' ' ILE . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.414 ' HA ' HG21 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.928 HD13 HD23 ' A' ' 16' ' ' LEU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' MET . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.623 HG22 ' HB1' ' A' ' 74' ' ' ALA . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.629 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.669 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.515 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.614 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.884 HD11 ' HE2' ' A' ' 59' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.46 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.418 HD21 ' HA ' ' A' ' 45' ' ' ASN . 1.3 m120 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.498 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.459 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.731 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.514 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.681 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.486 HD23 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.731 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE2' HD11 ' A' ' 35' ' ' LEU . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 60' ' ' ILE . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.68 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.405 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.652 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.602 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.505 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.623 ' HB1' HG22 ' A' ' 25' ' ' ILE . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.816 HD13 ' HB3' ' A' ' 84' ' ' ALA . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.65 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.816 ' HB3' HD13 ' A' ' 75' ' ' LEU . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.938 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.732 HD13 ' CE2' ' A' ' 68' ' ' TYR . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.521 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.496 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.897 ' HB3' ' CE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.521 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.952 ' HB2' HD21 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.747 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.8 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.453 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.747 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.678 HD13 HD11 ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.787 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.535 ' H ' HG22 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.737 HG22 ' HB3' ' A' ' 74' ' ' ALA . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.732 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.42 ' HB2' HD13 ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 40' ' ' GLU . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.58 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.667 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 1.069 HD11 ' HE2' ' A' ' 59' ' ' MET . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.405 HD13 ' H ' ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.761 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 1.013 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.46 ' HB ' ' SD ' ' A' ' 26' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.691 ' HG3' ' HE1' ' A' ' 26' ' ' MET . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.496 HD21 ' HA ' ' A' ' 45' ' ' ASN . 0.5 OUTLIER -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.752 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.753 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.73 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.752 ' HB3' ' HG3' ' A' ' 49' ' ' GLN . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.753 ' HB1' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.662 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.652 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 1.069 ' HE2' HD11 ' A' ' 35' ' ' LEU . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.432 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.897 ' CE2' ' HB3' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.463 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HE2' HD11 ' A' ' 9' ' ' LEU . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.586 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.486 ' CD2' ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.602 ' HB3' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.952 HD21 ' HB2' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.807 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.645 HD11 ' CE2' ' A' ' 68' ' ' TYR . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.596 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 5.1 ptp . . . . . 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HB2' HD23 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.758 ' HA ' HD11 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.517 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.4 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.671 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.498 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.712 HD12 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.668 ' HB2' HD12 ' A' ' 56' ' ' LEU . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.653 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 ' HE2' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' A' ' 30' ' ' ILE . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.724 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.668 ' HA ' HD21 ' A' ' 45' ' ' ASN . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.531 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.724 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.502 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.509 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.509 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.64 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.626 ' O ' ' HG3' ' A' ' 59' ' ' MET . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.671 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 58' ' ' LYS . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.732 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.596 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.622 HD13 HD13 ' A' ' 10' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.732 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.631 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.675 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.712 HD23 HD12 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 76' ' ' LEU . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.497 ' O ' ' HD2' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.611 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.694 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.562 HD11 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.721 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.73 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.73 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.721 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.667 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.477 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.418 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.1 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 1.008 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 1.008 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.67 ' CD1' ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.623 HG22 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.623 ' H ' HG22 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.664 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.485 HD12 ' CD2' ' A' ' 80' ' ' TYR . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.716 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.431 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.716 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.65 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.788 HD23 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.639 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.628 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.567 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.58 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.839 HE21 ' HG3' ' A' ' 51' ' ' GLN . 26.7 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.839 ' HG3' HE21 ' A' ' 50' ' ' GLN . 39.4 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.628 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.606 ' HB1' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.641 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.495 ' HA ' HD11 ' A' ' 57' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.788 ' HE1' HD23 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD11 ' CG ' ' A' ' 71' ' ' PHE . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.41 ' O ' HD23 ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.538 ' O ' HG22 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.544 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.578 ' HD1' ' CD2' ' A' ' 68' ' ' TYR . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.644 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.667 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.62 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.644 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.769 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 7.5 t-160 -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.629 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.59 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo . . . . . 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.621 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.534 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.589 ' CB ' ' HA3' ' A' ' 90' ' ' GLY . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 1.019 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.441 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.3 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.762 HD22 HD11 ' A' ' 20' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.466 ' N ' HD11 ' A' ' 16' ' ' LEU . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.762 HD11 HD22 ' A' ' 16' ' ' LEU . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.713 HD12 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.882 ' HE1' ' HB ' ' A' ' 43' ' ' VAL . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.687 HG13 ' O ' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.537 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.646 ' HE1' ' CE2' ' A' ' 34' ' ' PHE . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.464 HD22 ' HE3' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.417 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.882 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.576 ' C ' HD21 ' A' ' 45' ' ' ASN . 0.1 OUTLIER -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.744 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.613 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 59' ' ' MET . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.471 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 60' ' ' ILE . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.836 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.641 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.464 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 25' ' ' ILE . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.713 HD23 HD12 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.614 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.435 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 1.019 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.589 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.468 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.668 ' HE1' ' HB3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.462 ' CB ' ' HA3' ' A' ' 90' ' ' GLY . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.513 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.531 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.739 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.661 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.873 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.566 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.471 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.794 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.56 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.886 HG23 ' HB3' ' A' ' 74' ' ' ALA . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.552 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.552 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.596 HD12 ' HE1' ' A' ' 59' ' ' MET . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.551 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.698 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG2' ' HB1' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.86 ' HA ' ' HB2' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG22 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.53 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.86 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.576 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.596 ' HE1' HD12 ' A' ' 35' ' ' LEU . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.51 ' O ' HG21 ' A' ' 60' ' ' ILE . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HB3' ' HE1' ' A' ' 1' ' ' MET . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.488 ' HA ' ' N ' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.42 ' O ' HG21 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.595 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.647 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.486 HG22 HG21 ' A' ' 91' ' ' ILE . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.6 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.886 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.739 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.462 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.486 HG21 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo . . . . . 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.913 ' HE1' HG23 ' A' ' 60' ' ' ILE . 29.6 ttm . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 120.946 0.403 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.866 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.866 ' HB1' ' HB3' ' A' ' 2' ' ' ASP . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.762 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.932 ' HB2' HD23 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.623 HD21 HG21 ' A' ' 57' ' ' ILE . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.586 ' HB2' ' CD2' ' A' ' 83' ' ' LEU . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.808 ' HG ' HD13 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.808 HD13 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.63 HG23 ' HG2' ' A' ' 52' ' ' ARG . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.799 HG23 ' HB2' ' A' ' 74' ' ' ALA . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.743 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.44 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.56 ' HE2' HD12 ' A' ' 35' ' ' LEU . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.743 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HA ' ' OE1' ' A' ' 39' ' ' GLU . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.412 ' HA ' HD12 ' A' ' 37' ' ' ILE . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.581 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.527 ' HD2' ' HE3' ' A' ' 55' ' ' MET . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.884 HG23 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.423 ' HG3' ' HE2' ' A' ' 26' ' ' MET . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.477 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.605 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 9.2 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.651 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.63 ' HG2' HG23 ' A' ' 22' ' ' THR . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.605 ' HB1' ' HG3' ' A' ' 49' ' ' GLN . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.884 ' HG3' HG23 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 26' ' ' MET . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.626 HD13 HD12 ' A' ' 20' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.638 ' HG3' ' O ' ' A' ' 55' ' ' MET . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.913 HG23 ' HE1' ' A' ' 1' ' ' MET . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.476 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.471 ' HA ' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.628 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.51 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.671 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.799 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 80' ' ' TYR . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.44 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.617 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.468 ' HA ' ' HB3' ' A' ' 85' ' ' ALA . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.586 ' CD2' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.422 HD12 HD22 ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.932 HD23 ' HB2' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.663 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo . . . . . 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.52 120.41 7.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.901 2.401 . . . . 0.0 112.337 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.4 pp -117.69 147.46 42.91 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.499 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 69.34 28.82 72.18 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.144 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.1 m -69.35 172.71 6.68 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 122.349 -0.501 . . . . 0.0 110.123 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.792 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 30.0 ttm -67.17 124.49 23.24 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.812 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.4 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 2' ' ' ASP . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.693 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.839 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.683 ' HA ' HD11 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.487 ' C ' ' H ' ' A' ' 14' ' ' GLU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.714 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.487 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.425 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.854 ' HG ' HD13 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.627 ' HA ' ' NZ ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.854 HD13 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.756 ' HA ' HD21 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.655 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.641 HD12 HD23 ' A' ' 75' ' ' LEU . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.59 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.59 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.649 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.752 HD13 ' HE3' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.528 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.709 HE21 ' HB1' ' A' ' 53' ' ' ALA . 1.7 tp60 -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.507 HE21 ' HG3' ' A' ' 51' ' ' GLN . 27.4 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HG3' HE21 ' A' ' 50' ' ' GLN . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.634 ' HG2' HG23 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.709 ' HB1' HE21 ' A' ' 49' ' ' GLN . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.663 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.87 HD11 ' HE2' ' A' ' 59' ' ' MET . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.622 HG13 ' O ' ' A' ' 53' ' ' ALA . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.594 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.87 ' HE2' HD11 ' A' ' 56' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.495 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.664 ' O ' HG22 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.715 ' HA ' ' HD1' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.792 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.664 HG22 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.726 ' HE2' HD12 ' A' ' 9' ' ' LEU . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.641 HD23 HD12 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.663 ' HD2' ' CD1' ' A' ' 80' ' ' TYR . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.515 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.509 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.839 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.795 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 87' ' ' LEU . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -80.81 24.29 0.68 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.7 m -132.93 158.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 O-C-N 121.842 -0.536 . . . . 0.0 111.456 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.5 t -124.97 70.04 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.5 t 77.35 -70.68 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.016 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 62.72 22.97 13.69 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.587 -179.831 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -86.33 177.96 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.724 2.282 . . . . 0.0 112.329 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -129.32 151.64 49.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.955 0.407 . . . . 0.0 110.698 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 178.68 -170.23 42.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.099 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -125.1 -114.81 0.29 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.058 0.456 . . . . 0.0 111.163 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.762 ' HE3' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm -99.31 156.81 16.8 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.991 ' HB3' ' HE1' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.977 ' HA ' HD12 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.542 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.3 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 20' ' ' ILE . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.927 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.927 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.635 ' HA ' HD21 ' A' ' 56' ' ' LEU . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.572 ' H ' HG21 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.622 ' HD1' ' CD2' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.953 HG23 ' HB3' ' A' ' 74' ' ' ALA . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.751 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.751 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.63 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.518 ' O ' HG21 ' A' ' 30' ' ' ILE . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.464 ' O ' HG22 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.475 ' HG3' ' CD1' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.631 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.643 ' HB ' ' HE2' ' A' ' 26' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.418 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.719 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' A' ' 55' ' ' MET . 49.2 tp60 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.711 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.604 ' O ' ' HG3' ' A' ' 59' ' ' MET . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.664 HD13 ' HE2' ' A' ' 59' ' ' MET . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.711 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.664 ' HE2' HD13 ' A' ' 56' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.624 ' O ' ' HE1' ' A' ' 1' ' ' MET . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.442 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.477 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 68' ' ' TYR . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.424 HG22 ' HD2' ' A' ' 92' ' ' PRO . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.667 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.953 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.709 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.426 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.664 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.501 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.613 ' HA ' HD11 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.613 HD11 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.977 HD12 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.485 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.419 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.579 HG21 ' HD2' ' A' ' 92' ' ' PRO . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.579 ' HD2' HG21 ' A' ' 91' ' ' ILE . 90.4 Cg_exo -45.09 -42.02 16.16 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.6 m -79.71 76.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.607 0.718 . . . . 0.0 112.317 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 95' ' ' SER . 4.2 m -102.42 49.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.28 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 94' ' ' VAL . 40.7 t 74.56 -62.79 0.45 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.197 0.599 . . . . 0.0 110.168 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.7 m -81.72 138.23 35.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.182 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.604 -0.712 . . . . 0.0 109.965 179.783 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.22 -179.46 5.28 Favored 'Trans proline' 0 CA--C 1.53 0.3 0 C-N-CA 122.616 2.211 . . . . 0.0 112.18 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.512 ' HA ' HD22 ' A' ' -3' ' ' LEU . 2.7 tm? -109.27 111.36 22.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.162 0.506 . . . . 0.0 109.688 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 89.59 85.33 1.32 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.038 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 39.2 m -124.74 -174.92 3.14 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.817 ' HE2' HG22 ' A' ' 60' ' ' ILE . 32.8 ttm -63.82 126.32 27.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.531 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.531 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.608 ' HB1' ' HA3' ' A' ' 90' ' ' GLY . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.625 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.866 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.541 ' HA ' HD11 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.422 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.1 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.621 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.445 ' HZ1' ' CG ' ' A' ' 19' ' ' ASP . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 18' ' ' LYS . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.679 HD13 HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.435 ' HA ' HD21 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.849 HD13 HD21 ' A' ' 75' ' ' LEU . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.785 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.557 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.697 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.697 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.654 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.435 HD22 ' HE3' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.508 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.46 HG13 ' HB2' ' A' ' 56' ' ' LEU . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.508 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HA ' ' HB2' ' A' ' 54' ' ' ALA . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.788 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.494 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.567 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.763 HD13 ' HE3' ' A' ' 59' ' ' MET . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.788 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.763 ' HE3' HD13 ' A' ' 56' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.817 HG22 ' HE2' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.49 ' O ' HD21 ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.867 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.867 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.456 ' CG ' HD13 ' A' ' 60' ' ' ILE . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' HB1' ' CG2' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.849 HD21 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.454 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.644 ' HD2' ' CD1' ' A' ' 80' ' ' TYR . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.454 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.447 ' HA ' HD11 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.479 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.447 HD11 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.866 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.608 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.673 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.454 ' HB2' ' H ' ' A' ' 93' ' ' VAL . 32.1 Cg_exo -61.26 -83.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.454 ' H ' ' HB2' ' A' ' 92' ' ' PRO . 6.2 m -144.5 162.11 14.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.726 0.774 . . . . 0.0 112.653 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 9.5 m -134.47 125.82 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.9 m -69.16 81.88 0.34 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.238 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.7 p 43.24 76.36 0.08 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.84 0.856 . . . . 0.0 112.821 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.253 1.252 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.238 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.032 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.17 64.84 7.89 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.189 2.593 . . . . 0.0 112.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 19.6 tp -85.79 143.03 28.52 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.84 179.45 51.63 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.704 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 14.3 p -151.7 -165.2 2.17 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HE3' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -87.92 -178.73 6.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 179.583 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.467 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.786 ' HB2' ' HE1' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.523 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.988 ' HA ' HD23 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.848 HD23 HG22 ' A' ' 57' ' ' ILE . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.599 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.599 ' CB ' ' HA ' ' A' ' 13' ' ' ARG . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.614 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.821 HD11 HG12 ' A' ' 57' ' ' ILE . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HB3' HD11 ' A' ' 25' ' ' ILE . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.59 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' A' ' 21' ' ' LYS . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.796 ' HB2' HD12 ' A' ' 56' ' ' LEU . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.655 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.412 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.805 HD12 ' HB2' ' A' ' 40' ' ' GLU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.623 ' HE1' ' CE2' ' A' ' 34' ' ' PHE . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.432 HG22 ' O ' ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.805 ' HB2' HD12 ' A' ' 30' ' ' ILE . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.642 HG21 ' HG3' ' A' ' 55' ' ' MET . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.472 HD21 ' HA ' ' A' ' 45' ' ' ASN . 2.9 m120 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.592 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 53' ' ' ALA . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 2.9 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.782 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.514 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.647 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.796 HD12 ' HB2' ' A' ' 26' ' ' MET . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.848 HG22 HD23 ' A' ' 10' ' ' LEU . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.701 ' HE1' HD11 ' A' ' 56' ' ' LEU . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 60' ' ' ILE . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.867 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.579 ' O ' HG21 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.634 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.579 HG21 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.652 ' HE2' ' CE1' ' A' ' 71' ' ' PHE . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.593 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.417 ' N ' HD11 ' A' ' 76' ' ' LEU . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.484 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.631 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.593 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.988 HD23 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.59 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.56 HD13 ' O ' ' A' ' 87' ' ' LEU . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo -61.32 165.04 13.63 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 6.9 p -78.92 120.72 30.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 111.69 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.31 54.38 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 122.097 0.951 . . . . 0.0 108.778 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 30.6 t -135.98 87.49 2.31 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.029 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 m -87.1 84.18 7.33 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.863 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.702 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.919 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -82.91 45.66 1.96 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.098 2.532 . . . . 0.0 113.111 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 59.6 tp -69.4 114.31 7.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 84.31 86.51 0.89 Allowed Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -178.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 32.9 m -129.87 159.72 35.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.006 0.432 . . . . 0.0 111.531 -178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? -99.64 -172.75 2.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.501 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.624 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.954 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.518 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.447 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 37.7 m-70 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.518 ' H ' ' C ' ' A' ' 11' ' ' GLN . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.645 HD13 HD13 ' A' ' 20' ' ' ILE . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.704 ' HA ' HG21 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.704 HG21 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.628 ' HA ' HD21 ' A' ' 56' ' ' LEU . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.495 ' H ' ' CG2' ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.554 HG21 ' HB3' ' A' ' 74' ' ' ALA . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.699 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.528 ' HB3' HD11 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.699 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.654 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.758 HD22 ' HE2' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HB3' ' HE2' ' A' ' 55' ' ' MET . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.616 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.688 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.701 HE21 ' HG3' ' A' ' 51' ' ' GLN . 16.5 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.701 ' HG3' HE21 ' A' ' 50' ' ' GLN . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.688 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.707 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.729 ' HA ' HD13 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.701 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.636 HD12 ' HB2' ' A' ' 26' ' ' MET . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.729 HD13 ' HA ' ' A' ' 54' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.758 ' HE2' HD22 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.529 ' N ' HD13 ' A' ' 60' ' ' ILE . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.424 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.654 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.645 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.573 HG13 ' HB ' ' A' ' 93' ' ' VAL . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 72' ' ' TYR . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.634 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.608 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.595 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.594 HD11 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.954 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.54 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.4 t-160 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.579 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.54 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.84 -22.09 10.55 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.573 ' HB ' HG13 ' A' ' 69' ' ' VAL . 86.3 t -79.91 128.32 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.6 p -116.43 80.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.898 0.856 . . . . 0.0 111.211 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.5 m -74.19 90.54 2.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.176 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.3 t -101.96 -40.73 6.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.256 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.888 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.411 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.411 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 16.5 Cg_exo -68.67 -32.99 22.68 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.157 2.572 . . . . 0.0 113.512 -179.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' -3' ' ' LEU . 3.5 mm? -80.95 -34.3 33.31 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.493 0.663 . . . . 0.0 110.687 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 144.46 117.24 1.14 Allowed Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.177 -1.011 . . . . 0.0 113.02 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.6 p -166.07 -155.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.722 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm -100.45 155.94 17.55 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.683 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.631 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 1.131 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.637 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.864 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.438 ' N ' HD12 ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.697 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.467 ' CG2' ' H ' ' A' ' 23' ' ' SER . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.467 ' H ' ' CG2' ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.547 HD11 HD21 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.74 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.674 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.74 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.674 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.511 HD11 ' HE3' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.68 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.64 ' HB2' HD12 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.774 HG21 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.526 HD21 ' HA ' ' A' ' 45' ' ' ASN . 0.3 OUTLIER -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.733 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HG2' ' HB1' ' A' ' 53' ' ' ALA . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.733 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HG2' ' CG2' ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.709 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.774 ' HG3' HG21 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.851 HD12 ' HE2' ' A' ' 59' ' ' MET . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.709 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.851 ' HE2' HD12 ' A' ' 56' ' ' LEU . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.494 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.575 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.572 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.722 ' HB2' ' HE2' ' A' ' 1' ' ' MET . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.499 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 80' ' ' TYR . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.551 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.58 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 1.131 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.662 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -61.89 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.1 m -124.01 133.03 70.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.125 0.488 . . . . 0.0 111.881 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -156.6 39.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 122.808 1.289 . . . . 0.0 108.882 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.8 p -163.92 -176.78 4.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.248 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 m -76.51 117.39 18.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.864 -179.405 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.449 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.449 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 83.1 Cg_endo -95.51 57.5 0.19 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 123.352 2.702 . . . . 0.0 112.95 -179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 21.6 tp -145.17 75.51 1.45 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.223 0.535 . . . . 0.0 110.499 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.51 79.67 0.26 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.607 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.2 m -155.88 172.03 19.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.481 ' HE3' HG23 ' A' ' 60' ' ' ILE . 0.8 OUTLIER -78.13 -149.49 0.04 OUTLIER 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.526 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.991 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.724 ' HA ' HD12 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.745 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.627 ' HB1' HD23 ' A' ' 83' ' ' LEU . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.745 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.526 HG13 ' HA ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.478 ' HB ' ' HA ' ' A' ' 53' ' ' ALA . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.775 HG22 ' HB2' ' A' ' 74' ' ' ALA . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.698 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.421 ' HB3' HD12 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.698 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.411 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.572 HD11 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' O ' HG21 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.548 HG22 ' CG ' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HG2' ' HB3' ' A' ' 53' ' ' ALA . 6.6 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 28.7 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.611 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' HG2' ' A' ' 49' ' ' GLN . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.689 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.893 HD11 ' HE3' ' A' ' 59' ' ' MET . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.656 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.893 ' HE3' HD11 ' A' ' 56' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.499 ' H ' HD11 ' A' ' 60' ' ' ILE . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.439 ' C ' HD23 ' A' ' 61' ' ' LEU . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.609 ' HG3' ' HG ' ' A' ' 67' ' ' SER . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.48 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG22 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.609 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.637 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.596 ' HE2' ' CE1' ' A' ' 71' ' ' PHE . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.6 ' CE1' ' HB2' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.775 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.462 HD12 ' HB1' ' A' ' 84' ' ' ALA . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 80' ' ' TYR . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.692 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.6 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.991 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.546 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.519 HD11 ' CE2' ' A' ' 68' ' ' TYR . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.03 -72.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.13 135.68 47.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 111.544 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.72 63.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 122.55 1.167 . . . . 0.0 109.345 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.0 m -89.47 -35.63 15.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.461 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.7 p -92.63 116.24 28.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.857 0.361 . . . . 0.0 110.501 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.202 -179.45 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.074 -0.411 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.27 74.18 5.28 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.46 2.106 . . . . 0.0 111.723 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.5 136.12 33.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.517 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -130.3 5.05 5.96 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.898 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 10.2 t -118.23 -137.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.769 0.319 . . . . 0.0 110.193 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.774 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 30.3 ttm -100.86 140.8 34.63 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 121.998 -0.439 . . . . 0.0 110.751 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.747 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' HB3' ' A' ' 2' ' ' ASP . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.637 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.834 ' HA ' HD23 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' HD21 ' A' ' 16' ' ' LEU . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.544 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.8 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.444 ' O ' ' HD2' ' A' ' 18' ' ' LYS . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.495 ' N ' HD11 ' A' ' 16' ' ' LEU . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.653 HG23 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.935 HG23 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.742 ' H ' HG21 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 1.026 HG23 ' HB3' ' A' ' 74' ' ' ALA . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.756 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 74' ' ' ALA . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.581 ' HE2' HD13 ' A' ' 35' ' ' LEU . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.756 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 29' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.616 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 1.0 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.673 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 0.7 OUTLIER -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.935 ' HG2' HG23 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.688 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.644 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.78 HD11 ' HE2' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.688 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.78 ' HE2' HD11 ' A' ' 56' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.654 ' O ' ' HE2' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.635 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.89 ' HH ' ' HB3' ' A' ' 87' ' ' LEU . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.699 HG11 ' HB ' ' A' ' 93' ' ' VAL . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD12 ' A' ' 9' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.515 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 1.026 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.904 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.543 ' CD2' HD13 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.904 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.574 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.515 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.89 ' HB3' ' HH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo -76.5 -40.85 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.699 ' HB ' HG11 ' A' ' 69' ' ' VAL . 42.0 t -81.67 84.75 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.285 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.6 m -98.6 37.49 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.477 0.656 . . . . 0.0 110.008 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 45.9 m -146.06 82.93 1.62 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.292 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.6 m -80.0 138.2 36.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.399 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.132 -0.937 . . . . 0.0 109.499 -179.767 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.063 -0.415 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -62.32 -33.92 79.01 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.999 2.466 . . . . 0.0 112.43 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.1 pp -81.79 7.67 12.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.535 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -85.94 64.46 4.07 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.235 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 2.6 p -152.18 -172.85 4.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.531 0.205 . . . . 0.0 110.794 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.895 ' HE2' ' H ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -71.72 -177.24 1.86 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 1.0 ' HB2' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.721 ' HD3' ' HE1' ' A' ' 1' ' ' MET . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.558 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.69 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.91 ' HA ' HD23 ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.558 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.502 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.522 ' HB3' ' CD2' ' A' ' 83' ' ' LEU . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.826 HD21 HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HA ' HG21 ' A' ' 20' ' ' ILE . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.826 HD12 HD21 ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.679 HG22 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG22 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.607 ' HD2' ' CD1' ' A' ' 24' ' ' TYR . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.76 HG23 ' HB3' ' A' ' 74' ' ' ALA . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.665 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.501 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.469 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.665 HG13 ' O ' ' A' ' 26' ' ' MET . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HB3' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.668 ' HE2' ' CE1' ' A' ' 34' ' ' PHE . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.469 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.562 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.626 HE21 ' HG2' ' A' ' 51' ' ' GLN . 32.4 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.626 ' HG2' HE21 ' A' ' 50' ' ' GLN . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.734 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.611 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.977 HD12 ' HE1' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.448 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.977 ' HE1' HD12 ' A' ' 56' ' ' LEU . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.645 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.448 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.475 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.612 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.498 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.0 ' HE2' ' HB2' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.547 HG21 HG21 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.489 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.405 ' HE2' HD12 ' A' ' 9' ' ' LEU . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.452 ' CD1' ' HB3' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.76 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.623 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HB3' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.53 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.91 HD23 ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.551 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.547 HG21 HG21 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo -72.59 -8.24 22.18 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.496 ' H ' HG22 ' A' ' 91' ' ' ILE . 39.5 t -83.52 110.15 17.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.128 0.49 . . . . 0.0 110.249 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.3 m -125.66 40.71 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.286 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.8 t -161.05 82.16 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.235 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.2 p -82.23 -171.25 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.424 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.31 179.246 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.36 126.17 12.62 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.801 2.334 . . . . 0.0 111.863 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -145.93 109.09 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.078 0.466 . . . . 0.0 109.988 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 161.35 -171.47 37.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.824 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 14.5 m -82.37 176.01 9.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.585 0.231 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.705 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 0.5 OUTLIER -80.52 -172.19 3.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 179.5 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.98 ' HB1' ' HE1' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HB2' ' CG ' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.507 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD12 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HA ' HD12 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.441 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.711 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.869 ' HG ' HD11 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.51 ' N ' HD21 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.869 HD11 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.645 ' HB ' ' HA ' ' A' ' 53' ' ' ALA . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.583 HD13 HD22 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.556 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.533 ' HE3' HD13 ' A' ' 35' ' ' LEU . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.556 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.65 ' HE2' ' CE1' ' A' ' 34' ' ' PHE . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.533 HD13 ' HE3' ' A' ' 29' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.708 ' HB2' HD12 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.442 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.759 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.711 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 98.9 mm-40 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 48' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.759 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.805 HD13 ' HE2' ' A' ' 59' ' ' MET . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.737 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.805 ' HE2' HD13 ' A' ' 56' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.649 HG23 ' HE2' ' A' ' 1' ' ' MET . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.472 ' O ' HD23 ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.51 ' O ' ' HA ' ' A' ' -1' ' ' SER . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.514 ' N ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.562 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.665 ' HE1' ' CE2' ' A' ' 68' ' ' TYR . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.414 ' CD2' ' HB2' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.583 HD22 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.618 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.58 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.414 ' HB2' ' CD2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.523 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -60.68 -67.21 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.5 m -130.14 152.82 38.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.094 0.473 . . . . 0.0 110.877 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.8 t -106.9 66.33 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.187 0.518 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.2 m 62.83 -177.6 0.14 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.794 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.9 m -129.89 39.87 3.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 109.892 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.686 -0.673 . . . . 0.0 111.022 -179.538 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.58 -172.29 1.42 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.919 2.413 . . . . 0.0 112.259 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 64' ' ' ASP . 1.6 tt -141.84 126.08 17.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -145.48 13.32 1.8 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 119.872 -1.156 . . . . 0.0 114.308 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.2 p -155.07 166.42 33.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.943 0.871 . . . . 0.0 112.669 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.564 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 24.5 ttm -104.22 149.38 25.34 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.51 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.788 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 1.034 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.779 ' HA ' HD12 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.573 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.573 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.944 HD11 HD13 ' A' ' 20' ' ' ILE . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.944 HD13 HD11 ' A' ' 16' ' ' LEU . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.538 ' HA ' HD21 ' A' ' 56' ' ' LEU . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 24' ' ' TYR . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.683 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.496 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.759 HG12 ' O ' ' A' ' 26' ' ' MET . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.595 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.729 HD12 ' HE3' ' A' ' 59' ' ' MET . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.621 HD13 ' H ' ' A' ' 37' ' ' ILE . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.555 HG23 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.817 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.866 HE21 ' HG3' ' A' ' 51' ' ' GLN . 14.4 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.866 ' HG3' HE21 ' A' ' 50' ' ' GLN . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.817 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.549 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.631 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.579 HD12 ' HE2' ' A' ' 59' ' ' MET . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.751 HG12 HG23 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.729 ' HE3' HD12 ' A' ' 35' ' ' LEU . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.554 ' O ' ' HE2' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' -3' ' ' LEU . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.671 ' O ' HG22 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.595 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.626 ' HD1' ' CD2' ' A' ' 68' ' ' TYR . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.671 HG22 ' O ' ' A' ' 65' ' ' ASN . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.645 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.659 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.447 ' CB ' HG21 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.683 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.828 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.828 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.56 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.596 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.56 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.546 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.1 t-160 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.546 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -73.43 -68.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.8 m -135.5 149.02 28.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.477 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.2 t -89.28 75.0 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.645 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.7 m 52.05 43.91 30.01 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.895 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.2 t -150.23 134.15 16.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.107 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.629 -0.7 . . . . 0.0 110.423 -179.97 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.207 -0.357 . . . . 0.0 112.207 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -86.38 -0.5 8.27 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 122.898 2.399 . . . . 0.0 113.276 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -109.0 144.88 36.41 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.148 -0.345 . . . . 0.0 111.067 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -129.08 -45.89 0.18 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 1' ' ' MET . 4.3 p -157.79 -140.84 0.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.751 ' HE1' ' HB2' ' A' ' 68' ' ' TYR . 0.7 OUTLIER -74.45 179.63 4.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.664 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.654 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.954 ' HA ' HD12 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 13' ' ' ARG . 3.4 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.811 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.811 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.575 ' HA ' HG21 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.575 HG21 ' HA ' ' A' ' 17' ' ' GLU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.754 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.439 ' H ' ' CG2' ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.643 ' HE2' ' CE1' ' A' ' 24' ' ' TYR . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.616 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.822 ' HE2' HD13 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.757 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.822 HD13 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.526 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.808 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.975 HD23 ' HE2' ' A' ' 59' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.627 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.593 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.524 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.549 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.581 HE21 ' HG3' ' A' ' 51' ' ' GLN . 19.0 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.581 ' HG3' HE21 ' A' ' 50' ' ' GLN . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.549 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.632 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.754 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.662 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.975 ' HE2' HD23 ' A' ' 35' ' ' LEU . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.483 HG21 ' HE2' ' A' ' 1' ' ' MET . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 10' ' ' LEU . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG3' ' HG ' ' A' ' 67' ' ' SER . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.495 ' N ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.808 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.751 ' HB2' ' HE1' ' A' ' 1' ' ' MET . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.667 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.545 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.616 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.45 ' O ' ' HB1' ' A' ' 85' ' ' ALA . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.641 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 81' ' ' LYS . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.954 HD12 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.441 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.642 HD11 ' CE2' ' A' ' 68' ' ' TYR . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -87.09 23.8 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 71.2 t -132.04 101.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.806 0.336 . . . . 0.0 110.364 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 m -84.45 68.56 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.472 0.654 . . . . 0.0 110.508 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 29.4 t -67.58 117.11 9.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.636 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -98.28 177.3 5.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.462 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.072 -0.966 . . . . 0.0 109.617 179.848 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.03 94.13 0.55 Allowed 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 122.858 2.372 . . . . 0.0 111.923 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 93.8 mt -114.37 127.35 55.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.453 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 66.75 62.9 4.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.444 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.454 ' H ' ' HB3' ' A' ' 64' ' ' ASP . 40.7 m -111.62 41.32 1.93 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.332 . . . . 0.0 111.673 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.599 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm -100.76 123.65 45.26 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.923 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 5' ' ' ALA . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' A' ' 2' ' ' ASP . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.599 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.454 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.785 HD12 ' HE1' ' A' ' 71' ' ' PHE . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.669 HD11 ' HG ' ' A' ' 61' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.673 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.4 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.866 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.977 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.977 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.668 ' HB2' ' HE1' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.426 ' H ' HG22 ' A' ' 22' ' ' THR . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.407 ' H ' ' CG2' ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.626 ' HD2' ' CD1' ' A' ' 24' ' ' TYR . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.906 HD12 HD21 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.757 ' HE3' ' HB ' ' A' ' 43' ' ' VAL . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.735 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.711 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.628 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.735 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.52 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.757 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.971 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.962 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.971 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.962 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.587 ' HB2' ' HG2' ' A' ' 49' ' ' GLN . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.614 ' HG3' HG23 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.781 HD11 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.511 ' CD1' HG23 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.781 ' HE1' HD11 ' A' ' 56' ' ' LEU . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 10' ' ' LEU . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.454 ' HB3' ' H ' ' A' ' -1' ' ' SER . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.632 ' O ' HG21 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.653 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.659 HG13 HG22 ' A' ' 93' ' ' VAL . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.645 ' HE1' ' CE2' ' A' ' 71' ' ' PHE . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.666 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.906 HD21 HD12 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.416 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.437 ' HA ' ' HG ' ' A' ' 87' ' ' LEU . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.724 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.547 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.628 HG23 HG22 ' A' ' 69' ' ' VAL . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.53 1.57 1.65 Allowed 'Trans proline' 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.659 HG22 HG13 ' A' ' 69' ' ' VAL . 17.1 m -118.09 109.0 25.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.752 0.787 . . . . 0.0 111.932 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.7 81.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.633 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.0 m -84.27 -76.88 0.28 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.284 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.5 m -119.6 -43.38 2.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.071 0.463 . . . . 0.0 110.212 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.5 m . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.821 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.67 -28.57 82.64 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.614 2.209 . . . . 0.0 112.515 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.9 mp -109.27 110.2 21.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 110.38 43.02 1.1 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.377 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 18.6 p -155.29 131.92 10.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.528 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.532 ' CG ' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? -101.87 -176.67 3.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.552 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.835 ' HB3' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.556 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.938 ' HA ' HD22 ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.726 HD21 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.413 ' C ' ' H ' ' A' ' 13' ' ' ARG . 6.3 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.928 HD23 HD13 ' A' ' 20' ' ' ILE . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.414 ' HA ' HG21 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.928 HD13 HD23 ' A' ' 16' ' ' LEU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' MET . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.623 HG22 ' HB1' ' A' ' 74' ' ' ALA . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.629 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.669 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.515 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.614 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.884 HD11 ' HE2' ' A' ' 59' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.46 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.418 HD21 ' HA ' ' A' ' 45' ' ' ASN . 1.3 m120 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.498 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.459 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.731 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.514 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.681 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.486 HD23 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.731 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE2' HD11 ' A' ' 35' ' ' LEU . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.531 ' H ' HD12 ' A' ' 60' ' ' ILE . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.68 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.405 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.652 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.602 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.505 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.623 ' HB1' HG22 ' A' ' 25' ' ' ILE . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.816 HD13 ' HB3' ' A' ' 84' ' ' ALA . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.65 ' HE2' ' CE1' ' A' ' 80' ' ' TYR . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.816 ' HB3' HD13 ' A' ' 75' ' ' LEU . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.938 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.732 HD13 ' CE2' ' A' ' 68' ' ' TYR . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.14 -51.79 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -154.31 142.89 13.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.501 HG21 ' HE2' ' A' ' 72' ' ' TYR . 10.6 t -93.8 67.59 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.438 0.637 . . . . 0.0 110.373 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.0 m -96.69 -7.97 32.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.881 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.6 m -81.37 67.61 7.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.64 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.437 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.041 -0.423 . . . . 0.0 112.041 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -85.71 73.17 3.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.553 2.169 . . . . 0.0 112.975 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -127.68 71.78 1.37 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.556 0.693 . . . . 0.0 110.561 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 99.52 32.58 5.67 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.676 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.7 t -157.59 174.49 15.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.521 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? -77.85 175.38 10.06 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.496 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.897 ' HB3' ' CE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.521 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.952 ' HB2' HD21 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.747 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.8 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.453 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.69 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.747 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.678 HD13 HD11 ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.787 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.535 ' H ' HG22 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.737 HG22 ' HB3' ' A' ' 74' ' ' ALA . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.732 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.42 ' HB2' HD13 ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 40' ' ' GLU . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.58 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.667 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 1.069 HD11 ' HE2' ' A' ' 59' ' ' MET . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.405 HD13 ' H ' ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.761 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 1.013 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.46 ' HB ' ' SD ' ' A' ' 26' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.691 ' HG3' ' HE1' ' A' ' 26' ' ' MET . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.496 HD21 ' HA ' ' A' ' 45' ' ' ASN . 0.5 OUTLIER -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.752 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.753 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.73 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.752 ' HB3' ' HG3' ' A' ' 49' ' ' GLN . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.753 ' HB1' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.662 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.652 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 1.069 ' HE2' HD11 ' A' ' 35' ' ' LEU . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.712 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.432 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.897 ' CE2' ' HB3' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.463 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HE2' HD11 ' A' ' 9' ' ' LEU . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.658 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.606 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.586 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.486 ' CD2' ' HB1' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.602 ' HB3' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.952 HD21 ' HB2' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.515 ' NE2' ' HA ' ' A' ' 94' ' ' VAL . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.807 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.645 HD11 ' CE2' ' A' ' 68' ' ' TYR . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.17 -30.02 91.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.1 t -81.76 103.5 8.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.017 179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.515 ' HA ' ' NE2' ' A' ' 88' ' ' HIS . 5.9 p -123.06 76.29 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 122.024 0.916 . . . . 0.0 110.295 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.8 t -166.22 167.16 16.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.058 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.6 t -82.82 -171.5 3.57 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.312 -179.821 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.83 95.57 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.846 2.364 . . . . 0.0 112.786 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' -3' ' ' LEU . 2.1 tm? -88.61 119.84 29.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -171.58 146.44 9.46 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.888 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 49.4 m -70.21 -161.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.728 0.299 . . . . 0.0 111.129 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.596 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 5.1 ptp -71.0 -164.46 0.1 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HB2' HD23 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.758 ' HA ' HD11 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.517 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.4 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.52 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.671 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.67 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.498 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.712 HD12 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.668 ' HB2' HD12 ' A' ' 56' ' ' LEU . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.653 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 ' HE2' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' A' ' 30' ' ' ILE . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.724 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.668 ' HA ' HD21 ' A' ' 45' ' ' ASN . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.531 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.724 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.502 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.509 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.509 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.64 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.626 ' O ' ' HG3' ' A' ' 59' ' ' MET . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.671 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 58' ' ' LYS . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.732 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.596 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.622 HD13 HD13 ' A' ' 10' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.732 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.631 ' HD1' ' CD2' ' A' ' 71' ' ' PHE . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.675 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.712 HD23 HD12 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 76' ' ' LEU . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.497 ' O ' ' HD2' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.401 ' O ' HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.611 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.814 HD23 ' HB2' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.694 ' HA3' ' HB1' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.562 HD11 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.24 -147.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.96 111.44 19.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.037 0.446 . . . . 0.0 111.25 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.413 ' H ' HG21 ' A' ' 94' ' ' VAL . 3.4 m -95.72 73.46 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.884 0.85 . . . . 0.0 109.749 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.9 t -89.0 115.03 26.26 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.706 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 t -94.02 -33.79 13.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.246 0.92 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.263 179.083 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.051 -0.419 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -82.14 162.75 17.81 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.594 2.196 . . . . 0.0 112.682 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -92.0 98.28 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.683 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 169.04 42.83 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.16 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 48.6 m -104.15 77.37 1.42 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.721 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm -103.72 140.64 37.32 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 121.709 -0.62 . . . . 0.0 109.424 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.73 ' HB3' ' HB2' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.73 ' HB2' ' HB3' ' A' ' 2' ' ' ASP . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.721 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.667 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.477 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.418 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.1 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 1.008 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 1.008 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.67 ' CD1' ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.623 HG22 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.623 ' H ' HG22 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.664 ' HE1' ' CE2' ' A' ' 24' ' ' TYR . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.485 HD12 ' CD2' ' A' ' 80' ' ' TYR . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.716 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.431 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.716 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.598 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.65 ' HD2' ' CD1' ' A' ' 34' ' ' PHE . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.788 HD23 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.639 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.628 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.567 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.478 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.58 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.839 HE21 ' HG3' ' A' ' 51' ' ' GLN . 26.7 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.839 ' HG3' HE21 ' A' ' 50' ' ' GLN . 39.4 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.628 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.606 ' HB1' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.641 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.495 ' HA ' HD11 ' A' ' 57' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.788 ' HE1' HD23 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD11 ' CG ' ' A' ' 71' ' ' PHE . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.41 ' O ' HD23 ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.538 ' O ' HG22 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.544 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.578 ' HD1' ' CD2' ' A' ' 68' ' ' TYR . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.644 ' HD2' ' CD1' ' A' ' 71' ' ' PHE . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.667 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.644 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.62 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.644 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.53 ' O ' ' HB2' ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.769 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 7.5 t-160 -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.629 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.59 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.86 -7.23 20.11 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.7 t -79.59 98.99 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.148 0.499 . . . . 0.0 109.985 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.1 p -135.62 38.4 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.617 1.198 . . . . 0.0 109.219 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.4 p -83.64 -71.42 0.5 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.637 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.9 m -125.07 86.14 2.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.572 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.452 -0.785 . . . . 0.0 110.273 -179.704 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 N-CA-C 112.152 -0.379 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -87.3 123.11 1.86 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.281 2.654 . . . . 0.0 112.543 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 8.3 mp -106.42 97.4 7.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.969 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -110.68 -77.23 0.9 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.486 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.671 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 49.4 m -140.52 157.52 45.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.813 0.339 . . . . 0.0 110.568 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.621 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -76.5 -166.03 0.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 -179.62 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.534 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.589 ' CB ' ' HA3' ' A' ' 90' ' ' GLY . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 1.019 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.441 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.3 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.762 HD22 HD11 ' A' ' 20' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.466 ' N ' HD11 ' A' ' 16' ' ' LEU . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.762 HD11 HD22 ' A' ' 16' ' ' LEU . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.713 HD12 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.882 ' HE1' ' HB ' ' A' ' 43' ' ' VAL . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.687 HG13 ' O ' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.537 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.646 ' HE1' ' CE2' ' A' ' 34' ' ' PHE . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.464 HD22 ' HE3' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.417 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.882 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.576 ' C ' HD21 ' A' ' 45' ' ' ASN . 0.1 OUTLIER -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.744 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.613 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.52 HD12 ' HE2' ' A' ' 59' ' ' MET . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.613 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.471 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.671 ' O ' ' HA ' ' A' ' -1' ' ' SER . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.836 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.641 ' HD2' ' CD1' ' A' ' 68' ' ' TYR . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.464 ' O ' ' HB3' ' A' ' 72' ' ' TYR . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 72' ' ' TYR . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 25' ' ' ILE . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.713 HD23 HD12 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.614 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.435 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 1.019 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.589 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.468 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo -84.28 37.57 0.64 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.1 t -116.68 113.66 43.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 m -113.17 53.86 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.22 0.533 . . . . 0.0 111.807 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.5 m -116.4 34.45 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.39 0.614 . . . . 0.0 110.466 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.4 p -109.2 114.66 28.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.082 0.467 . . . . 0.0 111.435 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.773 -1.108 . . . . 0.0 109.648 179.52 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -56.48 123.86 14.87 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.757 2.305 . . . . 0.0 112.182 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.407 ' C ' HD21 ' A' ' -3' ' ' LEU . 4.2 tt -71.03 116.63 11.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.082 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -141.07 137.32 8.09 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.486 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.642 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 27.8 p -148.4 163.73 36.24 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.524 0.19 . . . . 0.0 110.79 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.668 ' HE1' ' HB3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -77.03 163.64 26.49 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.462 ' CB ' ' HA3' ' A' ' 90' ' ' GLY . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.513 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.531 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.739 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.661 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.873 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.566 ' HB1' ' CD2' ' A' ' 83' ' ' LEU . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.471 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.794 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.56 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.886 HG23 ' HB3' ' A' ' 74' ' ' ALA . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.552 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.552 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.596 HD12 ' HE1' ' A' ' 59' ' ' MET . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.551 ' HB ' ' HE1' ' A' ' 26' ' ' MET . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.698 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG2' ' HB1' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.86 ' HA ' ' HB2' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG22 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.53 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.86 ' HB2' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.576 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.841 HG22 HD13 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.596 ' HE1' HD12 ' A' ' 35' ' ' LEU . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.51 ' O ' HG21 ' A' ' 60' ' ' ILE . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.668 ' HB3' ' HE1' ' A' ' 1' ' ' MET . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.488 ' HA ' ' N ' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.42 ' O ' HG21 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.595 ' HG ' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.647 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.504 HG11 ' H ' ' A' ' 95' ' ' SER . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.6 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.886 ' HB3' HG23 ' A' ' 25' ' ' ILE . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.593 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.6 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.739 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.462 ' HA3' ' CB ' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.486 HG21 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo -73.71 -72.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.01 170.14 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.064 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.9 m -102.88 101.8 12.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.377 0.608 . . . . 0.0 110.631 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.504 ' H ' HG11 ' A' ' 69' ' ' VAL . 23.1 p -52.41 121.63 7.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.33 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.0 m -105.01 -168.17 1.44 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.97 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.229 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.6 139.58 44.92 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.821 2.347 . . . . 0.0 112.86 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.456 ' HA ' HD12 ' A' ' -3' ' ' LEU . 4.3 mm? -88.36 151.29 22.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.74 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -126.51 84.65 0.34 Allowed Glycine 0 C--N 1.32 -0.348 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.712 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 9.5 t -158.04 -156.56 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.357 0.598 . . . . 0.0 110.585 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.913 ' HE1' HG23 ' A' ' 60' ' ' ILE . 29.6 ttm -101.62 177.63 4.86 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.373 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.866 ' HB3' ' HB1' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.866 ' HB1' ' HB3' ' A' ' 2' ' ' ASP . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.762 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.932 ' HB2' HD23 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.623 HD21 HG21 ' A' ' 57' ' ' ILE . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.784 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.586 ' HB2' ' CD2' ' A' ' 83' ' ' LEU . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.808 ' HG ' HD13 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.808 HD13 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.63 HG23 ' HG2' ' A' ' 52' ' ' ARG . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.799 HG23 ' HB2' ' A' ' 74' ' ' ALA . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.743 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.44 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.56 ' HE2' HD12 ' A' ' 35' ' ' LEU . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.743 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 34' ' ' PHE . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HA ' ' OE1' ' A' ' 39' ' ' GLU . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.412 ' HA ' HD12 ' A' ' 37' ' ' ILE . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.581 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.527 ' HD2' ' HE3' ' A' ' 55' ' ' MET . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.884 HG23 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.423 ' HG3' ' HE2' ' A' ' 26' ' ' MET . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.477 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.605 ' HG3' ' HB1' ' A' ' 53' ' ' ALA . 9.2 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.651 ' O ' ' HB1' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.63 ' HG2' HG23 ' A' ' 22' ' ' THR . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.605 ' HB1' ' HG3' ' A' ' 49' ' ' GLN . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.884 ' HG3' HG23 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 26' ' ' MET . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.626 HD13 HD12 ' A' ' 20' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.638 ' HG3' ' O ' ' A' ' 55' ' ' MET . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.913 HG23 ' HE1' ' A' ' 1' ' ' MET . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.476 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.471 ' HA ' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.628 ' HE2' ' CE1' ' A' ' 68' ' ' TYR . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.51 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.551 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.671 ' HD1' ' CD2' ' A' ' 72' ' ' TYR . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.799 ' HB2' HG23 ' A' ' 25' ' ' ILE . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 80' ' ' TYR . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.44 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.617 ' HD1' ' CD2' ' A' ' 80' ' ' TYR . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.468 ' HA ' ' HB3' ' A' ' 85' ' ' ALA . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.586 ' CD2' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.531 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.422 HD12 HD22 ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.932 HD23 ' HB2' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.663 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo -64.48 -62.05 0.1 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.1 t -104.57 104.39 16.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 t -79.14 73.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.432 0.634 . . . . 0.0 110.86 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 79.5 p -132.0 163.32 28.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.1 m -134.28 44.31 2.71 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.041 0.448 . . . . 0.0 110.38 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.164 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.697 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 30.0 ttm . . . . . 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.814 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.697 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.003 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 63.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.622 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.873 HD12 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.784 ' HA ' HD22 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.684 HD11 ' CD2' ' A' ' 80' ' ' TYR . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.746 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 41.3 m80 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.82 HD21 ' HE1' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 55' ' ' MET . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.727 ' HG2' HG21 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.62 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.43 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.686 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.784 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 HG21 ' A' ' 20' ' ' ILE . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.82 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.675 ' O ' HG23 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.739 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.814 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.485 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.535 HD23 HD13 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.684 ' CD2' HD11 ' A' ' 25' ' ' ILE . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.643 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.485 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 1.003 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.794 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.491 HD11 ' CE2' ' A' ' 68' ' ' TYR . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.548 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm . . . . . 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.461 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.901 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' A' ' 61' ' ' LEU . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 42.8 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 1.0 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.0 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.578 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.578 ' H ' HG23 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.491 ' H ' ' HD1' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' A' ' 80' ' ' TYR . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.758 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.751 HD21 ' HE1' ' A' ' 59' ' ' MET . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HG3' HD13 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.639 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.856 HG22 ' HG3' ' A' ' 55' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.407 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.55 ' O ' ' HB2' ' A' ' 55' ' ' MET . 10.6 tp-100 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.713 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.856 ' HG3' HG22 ' A' ' 43' ' ' VAL . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 22' ' ' THR . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.713 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.751 ' HE1' HD21 ' A' ' 35' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.471 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.65 ' O ' HG23 ' A' ' 69' ' ' VAL . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 1.025 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 65' ' ' ASN . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.534 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CG ' HD11 ' A' ' 25' ' ' ILE . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.491 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.901 HD11 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 87' ' ' LEU . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo . . . . . 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.631 ' SD ' ' HG2' ' A' ' 6' ' ' ARG . 32.8 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.532 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.896 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.949 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.566 ' HA ' HD13 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.644 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.44 ' HB2' HD23 ' A' ' 83' ' ' LEU . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.644 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.513 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 22' ' ' THR . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.593 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.835 HD11 ' HD2' ' A' ' 80' ' ' TYR . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.781 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.781 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.855 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.52 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 52' ' ' ARG . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.449 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 55' ' ' MET . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.799 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.588 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 22' ' ' THR . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.799 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.855 ' HE1' HD21 ' A' ' 35' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 ' HE1' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.472 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.882 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.896 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.514 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' HA ' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.8 HD23 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.835 ' HD2' HD11 ' A' ' 25' ' ' ILE . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.514 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.949 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 87' ' ' LEU . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.526 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.757 ' HA ' HD22 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.631 HD23 ' HG ' ' A' ' 16' ' ' LEU . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 13' ' ' ARG . 55.6 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.619 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.644 HD11 HD13 ' A' ' 57' ' ' ILE . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.733 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.733 HG22 ' HA ' ' A' ' 17' ' ' GLU . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.608 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.589 HD13 HD23 ' A' ' 75' ' ' LEU . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.663 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.413 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.772 HD13 ' HB2' ' A' ' 35' ' ' LEU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.663 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.772 ' HB2' HD13 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.527 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.584 ' HG2' HD22 ' A' ' 35' ' ' LEU . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.633 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.633 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.611 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' GLN . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.785 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.659 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.659 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.438 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.866 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.654 ' O ' HG23 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.645 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 77' ' ' HIS . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 25' ' ' ILE . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.495 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.477 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.517 HD11 ' CE2' ' A' ' 68' ' ' TYR . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo . . . . . 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.571 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.809 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.511 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.849 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' A' ' 13' ' ' ARG . 64.4 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.506 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' O ' ' A' ' 9' ' ' LEU . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.791 ' HA ' HG22 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.74 HG23 ' H ' ' A' ' 23' ' ' SER . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.74 ' H ' HG23 ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.57 HD13 HD23 ' A' ' 75' ' ' LEU . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.704 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.559 ' HB3' HD13 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.704 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.688 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.884 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.523 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HB2' HD13 ' A' ' 30' ' ' ILE . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.445 HG22 ' HG3' ' A' ' 55' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 46' ' ' GLU . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.703 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.713 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 22' ' ' THR . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.703 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.676 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.688 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.809 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.587 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.402 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.57 HD23 HD13 ' A' ' 25' ' ' ILE . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.56 ' CD1' HD11 ' A' ' 25' ' ' ILE . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.662 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.849 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.58 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.566 HG23 HG22 ' A' ' 69' ' ' VAL . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 72.8 Cg_endo . . . . . 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.447 ' CE ' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm . . . . . 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.627 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.861 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.616 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.883 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.714 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.958 HG21 ' HG2' ' A' ' 52' ' ' ARG . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.638 ' H ' HG23 ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.767 HD13 HD23 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.747 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.678 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.678 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.605 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.555 HD11 ' HE1' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.708 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.708 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.423 ' HB2' HD13 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.709 HG22 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.742 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.742 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.958 ' HG2' HG21 ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.705 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.522 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.709 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.705 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.68 ' HG3' ' O ' ' A' ' 55' ' ' MET . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.528 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.605 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.747 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.767 HD23 HD13 ' A' ' 25' ' ' ILE . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.576 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.861 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.661 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.8 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.562 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.986 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.884 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 1.031 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.431 ' C ' ' H ' ' A' ' 13' ' ' ARG . 58.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.031 HD13 ' HA ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.933 HD12 ' HG ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.706 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.544 HD13 HD23 ' A' ' 75' ' ' LEU . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.701 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.414 ' HB3' HD13 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.701 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.919 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' HB2' HD13 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.523 HG22 ' HG3' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.603 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.489 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 1.2 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.603 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.623 ' HB3' HG21 ' A' ' 22' ' ' THR . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.655 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.706 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.655 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.919 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.986 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.605 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.44 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.544 HD23 HD13 ' A' ' 25' ' ' ILE . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 25' ' ' ILE . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.884 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.699 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 21.7 Cg_exo . . . . . 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.801 ' HE1' HG23 ' A' ' 60' ' ' ILE . 30.3 ttm . . . . . 0 N--CA 1.444 -0.757 0 CA-C-O 120.861 0.362 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.903 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.639 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.484 HD21 HG22 ' A' ' 57' ' ' ILE . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 56.3 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.83 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.83 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.983 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.765 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.794 HD13 HD23 ' A' ' 75' ' ' LEU . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.765 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.765 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.842 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.773 HG22 ' HG3' ' A' ' 55' ' ' MET . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.672 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 81.6 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.983 ' HG2' HG21 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.773 ' HG3' HG22 ' A' ' 43' ' ' VAL . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.641 HD12 ' HE1' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.684 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.842 ' HE1' HD21 ' A' ' 35' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.801 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.413 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.903 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.408 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.659 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.927 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.542 ' CD2' HD11 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.927 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.577 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.659 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.749 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 1.012 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.573 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.699 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.721 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HG ' ' A' ' 16' ' ' LEU . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.573 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.609 ' CD2' HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.609 HD12 ' CD2' ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.679 HG23 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG23 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.648 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.498 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.483 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.693 HD13 ' HB2' ' A' ' 40' ' ' GLU . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.561 ' HB3' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.561 ' HD1' ' HB3' ' A' ' 32' ' ' ASP . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.534 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.693 ' HB2' HD13 ' A' ' 30' ' ' ILE . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.439 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.449 ' O ' ' HB2' ' A' ' 55' ' ' MET . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.738 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.627 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD12 ' CE ' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.627 ' HG3' ' O ' ' A' ' 55' ' ' MET . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.445 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.507 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.62 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 1.012 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.495 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.648 HD23 HD13 ' A' ' 25' ' ' ILE . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD11 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.687 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.721 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.468 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.606 HG23 HG22 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo . . . . . 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.504 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.496 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.449 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.52 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.815 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 13' ' ' ARG . 61.8 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.747 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.954 ' HG ' HD12 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.954 HD12 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' H ' HD12 ' A' ' 25' ' ' ILE . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.733 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD23 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.437 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.928 HD21 ' HE1' ' A' ' 59' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.485 ' HB2' HD13 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.614 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.727 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 2.0 tt0 -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.727 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 30.7 mm100 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 22' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.666 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.733 HD22 ' HA ' ' A' ' 22' ' ' THR . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.746 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.928 ' HE1' HD21 ' A' ' 35' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 59' ' ' MET . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.775 ' O ' HG23 ' A' ' 69' ' ' VAL . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.869 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 65' ' ' ASN . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.495 ' CE2' ' HB1' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.592 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.495 ' HB1' ' CE2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.815 HD11 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.529 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.57 ' HG3' ' HA ' ' A' ' 65' ' ' ASN . 24.5 ttm . . . . . 0 N--CA 1.432 -1.326 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 65' ' ' ASN . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.791 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.03 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.786 ' HA ' HD13 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' A' ' 13' ' ' ARG . 64.0 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.527 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 14' ' ' GLU . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.786 HD13 ' HA ' ' A' ' 10' ' ' LEU . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.558 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG21 HG12 ' A' ' 57' ' ' ILE . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.596 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.563 ' H ' HG23 ' A' ' 22' ' ' THR . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.84 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.777 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.509 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.514 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 35' ' ' LEU . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.887 ' HB2' HD13 ' A' ' 30' ' ' ILE . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.639 ' HB2' HD12 ' A' ' 30' ' ' ILE . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.638 HG22 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.495 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.845 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.845 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.742 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.649 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.791 HG12 HG21 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.649 ' HG3' ' O ' ' A' ' 55' ' ' MET . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.438 HG23 ' HE1' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.511 ' O ' ' HE2' ' A' ' 1' ' ' MET . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.69 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.626 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.791 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.69 HG23 ' O ' ' A' ' 65' ' ' ASN . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.418 ' HE2' HD13 ' A' ' 9' ' ' LEU . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.692 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.84 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.858 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CD1' HD11 ' A' ' 25' ' ' ILE . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.858 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 1.03 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.407 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 6.1 Cg_exo . . . . . 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.674 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.674 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.965 ' HA ' HD11 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.737 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' A' ' 13' ' ' ARG . 30.5 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' HG22 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.567 HD12 HD12 ' A' ' 16' ' ' LEU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.764 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.711 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.614 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.727 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.769 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.727 HD11 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.769 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.528 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.464 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.532 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.558 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 55' ' ' MET . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.707 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 55' ' ' MET . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 57' ' ' ILE . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.707 HD12 ' HA ' ' A' ' 58' ' ' LYS . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.834 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.788 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HZ ' HD11 ' A' ' 20' ' ' ILE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.487 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.614 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.965 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.416 HD13 ' CE2' ' A' ' 68' ' ' TYR . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.597 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 87' ' ' LEU . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.677 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 51.7 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.889 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.02 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.02 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HB2' ' HE2' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.694 HG23 ' H ' ' A' ' 23' ' ' SER . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.694 ' H ' HG23 ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.724 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.76 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.995 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 48' ' ' THR . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.976 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.995 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.976 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.76 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.517 HD12 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.737 HD11 HG21 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.611 ' HG3' ' O ' ' A' ' 55' ' ' MET . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 57' ' ' ILE . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.409 ' O ' ' HE2' ' A' ' 1' ' ' MET . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.727 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.735 ' OH ' ' HB3' ' A' ' 87' ' ' LEU . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 65' ' ' ASN . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.635 ' HE2' HD13 ' A' ' 9' ' ' LEU . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.508 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.694 ' HE2' ' HB2' ' A' ' 21' ' ' LYS . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 83' ' ' LEU . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.735 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.543 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 87' ' ' LEU . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo . . . . . 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.807 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.559 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.634 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.734 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.734 ' HG ' HD23 ' A' ' 10' ' ' LEU . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' HG22 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 17' ' ' GLU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.497 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.548 ' HA ' HD22 ' A' ' 56' ' ' LEU . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.688 HD13 HD23 ' A' ' 75' ' ' LEU . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.67 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.633 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.67 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.633 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.542 ' HG2' HD22 ' A' ' 35' ' ' LEU . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HG2' ' A' ' 55' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.497 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.697 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.548 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.697 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 62' ' ' LYS . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.697 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.807 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.402 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.694 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.688 HD23 HD13 ' A' ' 25' ' ' ILE . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.497 ' OH ' ' HD2' ' A' ' 21' ' ' LYS . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.629 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.694 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.73 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.544 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.919 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.544 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.959 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.825 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 55.0 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.461 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.825 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.533 HD12 ' HG ' ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.817 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.733 HD13 HD23 ' A' ' 75' ' ' LEU . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.411 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.595 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 30' ' ' ILE . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 37' ' ' ILE . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.646 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 1.004 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.585 HG22 ' HG3' ' A' ' 55' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.474 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.738 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.648 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.677 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.677 ' HG3' ' O ' ' A' ' 55' ' ' MET . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.723 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.919 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.607 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.445 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HD13 ' A' ' 25' ' ' ILE . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.624 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.577 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.624 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 83' ' ' LEU . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.959 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.617 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.547 HG23 HG22 ' A' ' 69' ' ' VAL . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 5.1 ptp . . . . . 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.815 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.421 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.017 ' HA ' HD11 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.86 ' HA ' HD13 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 66.1 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.45 ' CE1' HD22 ' A' ' 86' ' ' LEU . 36.7 m80 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.546 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.86 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.679 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.66 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.698 HD13 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' HG13 ' A' ' 30' ' ' ILE . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.463 HD11 ' HE1' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HA ' ' HE3' ' A' ' 26' ' ' MET . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.648 HG22 ' HG3' ' A' ' 55' ' ' MET . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.734 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.499 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.653 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.557 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.648 ' HG3' HG22 ' A' ' 43' ' ' VAL . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.636 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.754 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.448 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 61' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.754 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.815 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 70' ' ' SER . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.698 HD23 HD13 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.45 HD22 ' CE1' ' A' ' 12' ' ' HIS . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 1.017 HD11 ' HA ' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.66 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.53 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 13.1 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.705 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.705 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.69 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 1.015 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.066 ' HG ' HD12 ' A' ' 20' ' ' ILE . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 1.066 HD12 ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.634 HG23 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.634 ' H ' HG23 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.697 HD13 HD23 ' A' ' 75' ' ' LEU . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.725 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.725 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 28' ' ' HIS . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.871 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 38' ' ' SER . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 36' ' ' THR . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.661 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.644 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.564 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.602 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.912 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.644 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.912 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.656 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.773 HD11 HG21 ' A' ' 20' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.871 ' HE1' HD21 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.519 HG23 ' HE1' ' A' ' 1' ' ' MET . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.415 HD23 ' O ' ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' C ' ' HE2' ' A' ' 1' ' ' MET . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.706 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.576 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.846 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HE2' HD13 ' A' ' 9' ' ' LEU . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.485 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.697 HD23 HD13 ' A' ' 25' ' ' ILE . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.605 ' CD2' HD11 ' A' ' 25' ' ' ILE . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.658 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.688 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.786 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.623 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 87' ' ' LEU . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo . . . . . 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.634 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.542 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.813 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 1.018 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.409 ' C ' ' H ' ' A' ' 13' ' ' ARG . 58.8 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.64 HD11 HG21 ' A' ' 57' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.604 HD13 HG12 ' A' ' 57' ' ' ILE . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.575 ' H ' HG23 ' A' ' 22' ' ' THR . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.601 HD13 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.762 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.615 ' HB3' HD13 ' A' ' 35' ' ' LEU . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.762 HD11 ' HE2' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.555 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.722 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 37' ' ' ILE . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.632 ' HD3' HD22 ' A' ' 45' ' ' ASN . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.576 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.632 HD22 ' HD3' ' A' ' 42' ' ' LYS . 29.6 p30 -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.526 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.628 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.722 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.571 HG22 ' HE3' ' A' ' 1' ' ' MET . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HB2' ' HA ' ' A' ' 60' ' ' ILE . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.855 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.855 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.601 HD23 HD13 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.579 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.531 ' CD2' HD11 ' A' ' 25' ' ' ILE . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.579 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.627 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.782 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.475 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.554 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.528 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 13' ' ' ARG . 65.4 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.91 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.91 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.777 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.416 ' O ' HD12 ' A' ' 25' ' ' ILE . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.881 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.573 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.855 HD13 HD23 ' A' ' 75' ' ' LEU . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.55 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 30' ' ' ILE . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.714 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.533 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.485 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.811 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.881 ' HG2' HG21 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.811 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.593 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 60' ' ' ILE . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.786 HG21 HD11 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 55' ' ' MET . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 56' ' ' LEU . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.525 ' O ' ' HE3' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.651 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.572 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.757 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 65' ' ' ASN . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.645 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.855 HD23 HD13 ' A' ' 25' ' ' ILE . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.439 ' HD2' HD11 ' A' ' 25' ' ' ILE . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.602 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.645 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.522 HG23 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo . . . . . 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.779 ' HB3' ' HD3' ' A' ' 6' ' ' ARG . 29.6 ttm . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 120.946 0.403 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.923 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.779 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.942 ' HA ' HD11 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.906 ' HA ' HD13 ' A' ' 16' ' ' LEU . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.919 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.919 HD12 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.479 ' HA ' HD22 ' A' ' 56' ' ' LEU . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.63 HD13 HD23 ' A' ' 75' ' ' LEU . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.744 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' N ' ' A' ' 71' ' ' PHE . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD2' ' HB2' ' A' ' 70' ' ' SER . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.96 HD21 ' HE1' ' A' ' 59' ' ' MET . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.726 HG22 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 5.6 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.471 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.576 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 58' ' ' LYS . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.726 ' HG3' HG22 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 22' ' ' THR . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.626 ' HA ' HD12 ' A' ' 60' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.96 ' HE1' HD21 ' A' ' 35' ' ' LEU . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 57' ' ' ILE . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 10' ' ' LEU . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.577 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.498 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.923 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.526 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.628 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.63 HD23 HD13 ' A' ' 25' ' ' ILE . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.464 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.9 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.557 ' CD2' HD11 ' A' ' 25' ' ' ILE . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.628 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.701 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo . . . . . 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.52 120.41 7.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.901 2.401 . . . . 0.0 112.337 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.4 pp -117.69 147.46 42.91 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.499 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 69.34 28.82 72.18 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.144 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.1 m -69.35 172.71 6.68 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 122.349 -0.501 . . . . 0.0 110.123 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.697 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 30.0 ttm -67.17 124.49 23.24 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.814 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.697 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.003 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 63.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.622 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.873 HD12 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.784 ' HA ' HD22 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.684 HD11 ' CD2' ' A' ' 80' ' ' TYR . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.746 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 41.3 m80 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.82 HD21 ' HE1' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 55' ' ' MET . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.727 ' HG2' HG21 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.62 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.43 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.686 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.784 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 HG21 ' A' ' 20' ' ' ILE . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.82 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.675 ' O ' HG23 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.739 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.814 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.485 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.535 HD23 HD13 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.684 ' CD2' HD11 ' A' ' 25' ' ' ILE . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.643 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.485 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 1.003 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.794 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.617 HG22 HG22 ' A' ' 93' ' ' VAL . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -80.81 24.29 0.68 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.617 HG22 HG22 ' A' ' 91' ' ' ILE . 31.7 m -132.93 158.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 O-C-N 121.842 -0.536 . . . . 0.0 111.456 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.5 t -124.97 70.04 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.5 t 77.35 -70.68 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.016 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 62.72 22.97 13.69 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.587 -179.831 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -86.33 177.96 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.724 2.282 . . . . 0.0 112.329 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -129.32 151.64 49.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.955 0.407 . . . . 0.0 110.698 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 178.68 -170.23 42.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.099 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -125.1 -114.81 0.29 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.058 0.456 . . . . 0.0 111.163 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm -99.31 156.81 16.8 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.461 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.901 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' A' ' 61' ' ' LEU . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 42.8 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 1.0 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.0 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.578 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.578 ' H ' HG23 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.491 ' H ' ' HD1' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' A' ' 80' ' ' TYR . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.758 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.751 HD21 ' HE1' ' A' ' 59' ' ' MET . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HG3' HD13 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.639 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.856 HG22 ' HG3' ' A' ' 55' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.407 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.55 ' O ' ' HB2' ' A' ' 55' ' ' MET . 10.6 tp-100 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.713 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.856 ' HG3' HG22 ' A' ' 43' ' ' VAL . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 22' ' ' THR . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.713 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.751 ' HE1' HD21 ' A' ' 35' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.471 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.65 ' O ' HG23 ' A' ' 69' ' ' VAL . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 1.025 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 65' ' ' ASN . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.534 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CG ' HD11 ' A' ' 25' ' ' ILE . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.491 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.901 HD11 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' VAL . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -45.09 -42.02 16.16 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.6 m -79.71 76.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.607 0.718 . . . . 0.0 112.317 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.502 HG13 ' O ' ' A' ' 91' ' ' ILE . 4.2 m -102.42 49.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.28 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 94' ' ' VAL . 40.7 t 74.56 -62.79 0.45 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.197 0.599 . . . . 0.0 110.168 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.7 m -81.72 138.23 35.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.182 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.604 -0.712 . . . . 0.0 109.965 179.783 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.22 -179.46 5.28 Favored 'Trans proline' 0 CA--C 1.53 0.3 0 C-N-CA 122.616 2.211 . . . . 0.0 112.18 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -109.27 111.36 22.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.162 0.506 . . . . 0.0 109.688 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 89.59 85.33 1.32 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.038 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 39.2 m -124.74 -174.92 3.14 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.631 ' SD ' ' HG2' ' A' ' 6' ' ' ARG . 32.8 ttm -63.82 126.32 27.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.532 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.896 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.949 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.566 ' HA ' HD13 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.644 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.44 ' HB2' HD23 ' A' ' 83' ' ' LEU . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.644 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.513 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 22' ' ' THR . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.593 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.835 HD11 ' HD2' ' A' ' 80' ' ' TYR . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.781 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.781 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.855 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.52 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 52' ' ' ARG . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.449 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 55' ' ' MET . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.799 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.588 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 22' ' ' THR . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.799 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.855 ' HE1' HD21 ' A' ' 35' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 ' HE1' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.472 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.882 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.896 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.514 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' HA ' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.8 HD23 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.835 ' HD2' HD11 ' A' ' 25' ' ' ILE . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.514 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.949 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 87' ' ' LEU . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.26 -83.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 6.2 m -144.5 162.11 14.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.726 0.774 . . . . 0.0 112.653 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 9.5 m -134.47 125.82 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.9 m -69.16 81.88 0.34 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.238 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.7 p 43.24 76.36 0.08 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.84 0.856 . . . . 0.0 112.821 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.253 1.252 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.238 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.032 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.17 64.84 7.89 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.189 2.593 . . . . 0.0 112.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 19.6 tp -85.79 143.03 28.52 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.84 179.45 51.63 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.704 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 14.3 p -151.7 -165.2 2.17 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.526 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -87.92 -178.73 6.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 179.583 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.757 ' HA ' HD22 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.631 HD23 ' HG ' ' A' ' 16' ' ' LEU . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 13' ' ' ARG . 55.6 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.619 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.644 HD11 HD13 ' A' ' 57' ' ' ILE . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.733 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.733 HG22 ' HA ' ' A' ' 17' ' ' GLU . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.608 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.589 HD13 HD23 ' A' ' 75' ' ' LEU . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.663 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.413 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.772 HD13 ' HB2' ' A' ' 35' ' ' LEU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.663 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.772 ' HB2' HD13 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.527 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.584 ' HG2' HD22 ' A' ' 35' ' ' LEU . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.633 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.633 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.611 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' GLN . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.785 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.659 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.659 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.438 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.866 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.654 ' O ' HG23 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.645 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 77' ' ' HIS . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 25' ' ' ILE . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.495 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.477 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.517 HD11 ' CE2' ' A' ' 68' ' ' TYR . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo -61.32 165.04 13.63 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 6.9 p -78.92 120.72 30.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 111.69 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.31 54.38 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 122.097 0.951 . . . . 0.0 108.778 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 30.6 t -135.98 87.49 2.31 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.029 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 m -87.1 84.18 7.33 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.863 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.702 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.919 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -82.91 45.66 1.96 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.098 2.532 . . . . 0.0 113.111 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 59.6 tp -69.4 114.31 7.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 84.31 86.51 0.89 Allowed Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -178.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 32.9 m -129.87 159.72 35.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.006 0.432 . . . . 0.0 111.531 -178.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.571 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? -99.64 -172.75 2.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.809 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.511 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.849 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' A' ' 13' ' ' ARG . 64.4 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.506 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' O ' ' A' ' 9' ' ' LEU . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.791 ' HA ' HG22 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.74 HG23 ' H ' ' A' ' 23' ' ' SER . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.74 ' H ' HG23 ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.57 HD13 HD23 ' A' ' 75' ' ' LEU . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.704 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.559 ' HB3' HD13 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.704 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.688 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.884 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.523 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HB2' HD13 ' A' ' 30' ' ' ILE . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.445 HG22 ' HG3' ' A' ' 55' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 46' ' ' GLU . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.703 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.713 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 22' ' ' THR . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.703 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.676 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.688 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.809 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.587 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.402 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.57 HD23 HD13 ' A' ' 25' ' ' ILE . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.56 ' CD1' HD11 ' A' ' 25' ' ' ILE . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.662 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.849 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.58 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.566 HG23 HG22 ' A' ' 69' ' ' VAL . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 72.8 Cg_endo -77.84 -22.09 10.55 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.3 t -79.91 128.32 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.6 p -116.43 80.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.898 0.856 . . . . 0.0 111.211 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.5 m -74.19 90.54 2.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.176 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.3 t -101.96 -40.73 6.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.256 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.888 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.413 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.413 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 16.5 Cg_exo -68.67 -32.99 22.68 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.157 2.572 . . . . 0.0 113.512 -179.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.95 -34.3 33.31 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.493 0.663 . . . . 0.0 110.687 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 144.46 117.24 1.14 Allowed Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.177 -1.011 . . . . 0.0 113.02 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.6 p -166.07 -155.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.447 ' CE ' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm -100.45 155.94 17.55 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.627 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.861 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.616 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.883 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.714 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.958 HG21 ' HG2' ' A' ' 52' ' ' ARG . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.638 ' H ' HG23 ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.767 HD13 HD23 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.747 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.678 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.678 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.605 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.555 HD11 ' HE1' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.708 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.708 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.423 ' HB2' HD13 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.709 HG22 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.742 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.742 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.958 ' HG2' HG21 ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.705 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.522 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.709 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.705 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.68 ' HG3' ' O ' ' A' ' 55' ' ' MET . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.528 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.605 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.747 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.767 HD23 HD13 ' A' ' 25' ' ' ILE . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.576 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.861 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.661 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.8 Cg_exo -61.89 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.1 m -124.01 133.03 70.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.125 0.488 . . . . 0.0 111.881 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -156.6 39.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 122.808 1.289 . . . . 0.0 108.882 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.8 p -163.92 -176.78 4.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.248 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 m -76.51 117.39 18.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.864 -179.405 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.464 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.464 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 83.1 Cg_endo -95.51 57.5 0.19 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 123.352 2.702 . . . . 0.0 112.95 -179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 21.6 tp -145.17 75.51 1.45 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.223 0.535 . . . . 0.0 110.499 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.51 79.67 0.26 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.607 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.2 m -155.88 172.03 19.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.562 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -78.13 -149.49 0.04 OUTLIER 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.986 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.884 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 1.031 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.431 ' C ' ' H ' ' A' ' 13' ' ' ARG . 58.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.031 HD13 ' HA ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.933 HD12 ' HG ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.706 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.544 HD13 HD23 ' A' ' 75' ' ' LEU . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.701 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.414 ' HB3' HD13 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.701 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.919 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' HB2' HD13 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.523 HG22 ' HG3' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.603 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.489 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 1.2 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.603 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.623 ' HB3' HG21 ' A' ' 22' ' ' THR . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.655 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.706 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.655 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.919 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.986 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.605 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.44 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.544 HD23 HD13 ' A' ' 25' ' ' ILE . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 25' ' ' ILE . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.884 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.699 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 21.7 Cg_exo -65.03 -72.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.13 135.68 47.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 111.544 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.72 63.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 122.55 1.167 . . . . 0.0 109.345 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.0 m -89.47 -35.63 15.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.461 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.7 p -92.63 116.24 28.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.857 0.361 . . . . 0.0 110.501 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.202 -179.45 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.074 -0.411 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.27 74.18 5.28 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.46 2.106 . . . . 0.0 111.723 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.5 136.12 33.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.517 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -130.3 5.05 5.96 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.898 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 10.2 t -118.23 -137.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.769 0.319 . . . . 0.0 110.193 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.801 ' HE1' HG23 ' A' ' 60' ' ' ILE . 30.3 ttm -100.86 140.8 34.63 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 121.998 -0.439 . . . . 0.0 110.751 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.903 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.639 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD21 HG22 ' A' ' 57' ' ' ILE . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 56.3 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.83 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.83 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.983 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.765 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.794 HD13 HD23 ' A' ' 75' ' ' LEU . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.765 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.765 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.842 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.773 HG22 ' HG3' ' A' ' 55' ' ' MET . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.672 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 81.6 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.983 ' HG2' HG21 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.773 ' HG3' HG22 ' A' ' 43' ' ' VAL . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.641 HD12 ' HE1' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.684 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.842 ' HE1' HD21 ' A' ' 35' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.801 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.413 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.903 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.698 HG11 ' HB ' ' A' ' 93' ' ' VAL . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.408 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.659 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.927 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.542 ' CD2' HD11 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.927 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.577 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.659 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.749 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo -76.5 -40.85 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.698 ' HB ' HG11 ' A' ' 69' ' ' VAL . 42.0 t -81.67 84.75 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.285 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.6 m -98.6 37.49 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.477 0.656 . . . . 0.0 110.008 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 45.9 m -146.06 82.93 1.62 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.292 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.6 m -80.0 138.2 36.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.399 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.132 -0.937 . . . . 0.0 109.499 -179.767 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.063 -0.415 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -62.32 -33.92 79.01 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.999 2.466 . . . . 0.0 112.43 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' A' ' -3' ' ' LEU . 3.1 pp -81.79 7.67 12.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.535 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -85.94 64.46 4.07 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.235 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 2.6 p -152.18 -172.85 4.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.531 0.205 . . . . 0.0 110.794 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.456 ' H ' ' CE ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -71.72 -177.24 1.86 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 1.012 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.573 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.699 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.721 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HG ' ' A' ' 16' ' ' LEU . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.573 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.609 ' CD2' HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.609 HD12 ' CD2' ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.679 HG23 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG23 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.648 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.498 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.483 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.693 HD13 ' HB2' ' A' ' 40' ' ' GLU . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.561 ' HB3' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.561 ' HD1' ' HB3' ' A' ' 32' ' ' ASP . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.534 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.693 ' HB2' HD13 ' A' ' 30' ' ' ILE . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.439 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.449 ' O ' ' HB2' ' A' ' 55' ' ' MET . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.738 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.627 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD12 ' CE ' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.627 ' HG3' ' O ' ' A' ' 55' ' ' MET . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.445 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.507 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.62 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 1.012 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.495 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.648 HD23 HD13 ' A' ' 25' ' ' ILE . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD11 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.687 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.721 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.468 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.606 HG23 HG22 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo -72.59 -8.24 22.18 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.579 ' H ' HG22 ' A' ' 91' ' ' ILE . 39.5 t -83.52 110.15 17.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.128 0.49 . . . . 0.0 110.249 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.3 m -125.66 40.71 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.286 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.8 t -161.05 82.16 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.235 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.2 p -82.23 -171.25 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.424 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.31 179.246 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.36 126.17 12.62 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.801 2.334 . . . . 0.0 111.863 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' -3' ' ' LEU . 1.1 tm? -145.93 109.09 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.078 0.466 . . . . 0.0 109.988 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 161.35 -171.47 37.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.824 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.52 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 14.5 m -82.37 176.01 9.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.585 0.231 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.504 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -80.52 -172.19 3.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 179.5 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.496 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.449 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.52 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.815 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 13' ' ' ARG . 61.8 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.747 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.954 ' HG ' HD12 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.954 HD12 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' H ' HD12 ' A' ' 25' ' ' ILE . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.733 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD23 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.437 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.928 HD21 ' HE1' ' A' ' 59' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.485 ' HB2' HD13 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.614 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.727 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 2.0 tt0 -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.727 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 30.7 mm100 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 22' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.666 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.733 HD22 ' HA ' ' A' ' 22' ' ' THR . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.746 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.928 ' HE1' HD21 ' A' ' 35' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.52 ' O ' ' HA ' ' A' ' -1' ' ' SER . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.775 ' O ' HG23 ' A' ' 69' ' ' VAL . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.869 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 65' ' ' ASN . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.495 ' CE2' ' HB1' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.592 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.495 ' HB1' ' CE2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.815 HD11 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.529 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -60.68 -67.21 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.5 m -130.14 152.82 38.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.094 0.473 . . . . 0.0 110.877 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.8 t -106.9 66.33 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.187 0.518 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.2 m 62.83 -177.6 0.14 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.794 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.9 m -129.89 39.87 3.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 109.892 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.686 -0.673 . . . . 0.0 111.022 -179.538 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.58 -172.29 1.42 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.919 2.413 . . . . 0.0 112.259 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.557 HD22 ' HB3' ' A' ' 64' ' ' ASP . 1.6 tt -141.84 126.08 17.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -145.48 13.32 1.8 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 119.872 -1.156 . . . . 0.0 114.308 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.2 p -155.07 166.42 33.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.943 0.871 . . . . 0.0 112.669 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.57 ' HG3' ' HA ' ' A' ' 65' ' ' ASN . 24.5 ttm -104.22 149.38 25.34 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.51 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 65' ' ' ASN . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.791 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.03 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.786 ' HA ' HD13 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' A' ' 13' ' ' ARG . 64.0 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.527 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 14' ' ' GLU . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.786 HD13 ' HA ' ' A' ' 10' ' ' LEU . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.558 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG21 HG12 ' A' ' 57' ' ' ILE . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.596 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.563 ' H ' HG23 ' A' ' 22' ' ' THR . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.84 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.777 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.509 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.514 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 35' ' ' LEU . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.887 ' HB2' HD13 ' A' ' 30' ' ' ILE . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.639 ' HB2' HD12 ' A' ' 30' ' ' ILE . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.638 HG22 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.495 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.845 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.557 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.845 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.742 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.649 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.791 HG12 HG21 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.649 ' HG3' ' O ' ' A' ' 55' ' ' MET . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.438 HG23 ' HE1' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.557 ' HB3' HD22 ' A' ' -3' ' ' LEU . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.69 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.626 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.791 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.692 HG11 ' HA ' ' A' ' 94' ' ' VAL . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.418 ' HE2' HD13 ' A' ' 9' ' ' LEU . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.692 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.84 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.858 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CD1' HD11 ' A' ' 25' ' ' ILE . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.858 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 1.03 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.407 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 6.1 Cg_exo -73.43 -68.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.8 m -135.5 149.02 28.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.477 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.692 ' HA ' HG11 ' A' ' 69' ' ' VAL . 20.2 t -89.28 75.0 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.645 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.7 m 52.05 43.91 30.01 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.895 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.2 t -150.23 134.15 16.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.107 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.629 -0.7 . . . . 0.0 110.423 -179.97 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.207 -0.357 . . . . 0.0 112.207 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -86.38 -0.5 8.27 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 122.898 2.399 . . . . 0.0 113.276 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -109.0 144.88 36.41 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.148 -0.345 . . . . 0.0 111.067 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -129.08 -45.89 0.18 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.3 p -157.79 -140.84 0.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.674 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.7 OUTLIER -74.45 179.63 4.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.674 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.965 ' HA ' HD11 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.737 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' A' ' 13' ' ' ARG . 30.5 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' HG22 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.567 HD12 HD12 ' A' ' 16' ' ' LEU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.764 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.711 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.614 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.727 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.769 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.727 HD11 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.769 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.528 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.464 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.532 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.558 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 55' ' ' MET . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.707 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 55' ' ' MET . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 57' ' ' ILE . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.707 HD12 ' HA ' ' A' ' 58' ' ' LYS . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.834 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.788 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HZ ' HD11 ' A' ' 20' ' ' ILE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.487 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.614 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.965 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.688 HG22 ' H ' ' A' ' 93' ' ' VAL . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -87.09 23.8 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.688 ' H ' HG22 ' A' ' 91' ' ' ILE . 71.2 t -132.04 101.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.806 0.336 . . . . 0.0 110.364 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 m -84.45 68.56 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.472 0.654 . . . . 0.0 110.508 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 29.4 t -67.58 117.11 9.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.636 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -98.28 177.3 5.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.462 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.072 -0.966 . . . . 0.0 109.617 179.848 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.03 94.13 0.55 Allowed 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 122.858 2.372 . . . . 0.0 111.923 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 93.8 mt -114.37 127.35 55.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.453 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 66.75 62.9 4.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.444 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.53 ' H ' ' HB3' ' A' ' 64' ' ' ASP . 40.7 m -111.62 41.32 1.93 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.332 . . . . 0.0 111.673 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.597 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm -100.76 123.65 45.26 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.923 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 87' ' ' LEU . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.677 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 51.7 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.889 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.02 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.02 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HB2' ' HE2' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.694 HG23 ' H ' ' A' ' 23' ' ' SER . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.694 ' H ' HG23 ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.724 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.76 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.995 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 48' ' ' THR . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.976 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.995 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.976 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.76 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.517 HD12 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.737 HD11 HG21 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.611 ' HG3' ' O ' ' A' ' 55' ' ' MET . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 57' ' ' ILE . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB3' ' H ' ' A' ' -1' ' ' SER . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.727 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.735 ' OH ' ' HB3' ' A' ' 87' ' ' LEU . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 65' ' ' ASN . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.635 ' HE2' HD13 ' A' ' 9' ' ' LEU . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.508 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.694 ' HE2' ' HB2' ' A' ' 21' ' ' LYS . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 83' ' ' LEU . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.735 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.543 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 87' ' ' LEU . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.53 1.57 1.65 Allowed 'Trans proline' 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.534 ' H ' HG22 ' A' ' 91' ' ' ILE . 17.1 m -118.09 109.0 25.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.752 0.787 . . . . 0.0 111.932 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.7 81.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.633 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.0 m -84.27 -76.88 0.28 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.284 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.5 m -119.6 -43.38 2.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.071 0.463 . . . . 0.0 110.212 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.5 m . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.821 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.67 -28.57 82.64 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.614 2.209 . . . . 0.0 112.515 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.9 mp -109.27 110.2 21.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 110.38 43.02 1.1 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.377 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 18.6 p -155.29 131.92 10.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.528 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? -101.87 -176.67 3.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.807 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.559 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.634 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.734 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.734 ' HG ' HD23 ' A' ' 10' ' ' LEU . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' HG22 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 17' ' ' GLU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.497 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.548 ' HA ' HD22 ' A' ' 56' ' ' LEU . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.688 HD13 HD23 ' A' ' 75' ' ' LEU . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.67 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.633 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.67 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.633 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.542 ' HG2' HD22 ' A' ' 35' ' ' LEU . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HG2' ' A' ' 55' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.0 m-20 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.497 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.697 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.548 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.697 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 62' ' ' LYS . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.697 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.807 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.402 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.694 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.688 HD23 HD13 ' A' ' 25' ' ' ILE . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.497 ' OH ' ' HD2' ' A' ' 21' ' ' LYS . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.629 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.694 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.73 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.14 -51.79 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -154.31 142.89 13.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.471 ' HA ' HG11 ' A' ' 69' ' ' VAL . 10.6 t -93.8 67.59 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.438 0.637 . . . . 0.0 110.373 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.0 m -96.69 -7.97 32.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.881 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.6 m -81.37 67.61 7.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.64 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.437 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.041 -0.423 . . . . 0.0 112.041 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -85.71 73.17 3.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.553 2.169 . . . . 0.0 112.975 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -127.68 71.78 1.37 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.556 0.693 . . . . 0.0 110.561 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 99.52 32.58 5.67 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.676 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.7 t -157.59 174.49 15.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.544 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? -77.85 175.38 10.06 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.919 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.544 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.959 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.825 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 55.0 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.461 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.825 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.533 HD12 ' HG ' ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.817 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.733 HD13 HD23 ' A' ' 75' ' ' LEU . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.411 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.595 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 30' ' ' ILE . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 37' ' ' ILE . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.646 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 1.004 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.585 HG22 ' HG3' ' A' ' 55' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.474 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.738 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.648 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.677 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.677 ' HG3' ' O ' ' A' ' 55' ' ' MET . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.723 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.919 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.607 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.445 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HD13 ' A' ' 25' ' ' ILE . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.624 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.577 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.624 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 83' ' ' LEU . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.959 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.525 ' NE2' ' HA ' ' A' ' 94' ' ' VAL . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.617 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.547 HG23 HG22 ' A' ' 69' ' ' VAL . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.17 -30.02 91.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 91' ' ' ILE . 48.1 t -81.76 103.5 8.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.017 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.525 ' HA ' ' NE2' ' A' ' 88' ' ' HIS . 5.9 p -123.06 76.29 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 122.024 0.916 . . . . 0.0 110.295 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.8 t -166.22 167.16 16.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.058 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.6 t -82.82 -171.5 3.57 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.312 -179.821 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.83 95.57 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.846 2.364 . . . . 0.0 112.786 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' -3' ' ' LEU . 2.1 tm? -88.61 119.84 29.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -171.58 146.44 9.46 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.888 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 49.4 m -70.21 -161.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.728 0.299 . . . . 0.0 111.129 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 5.1 ptp -71.0 -164.46 0.1 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.815 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.421 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.017 ' HA ' HD11 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.86 ' HA ' HD13 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 66.1 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.45 ' CE1' HD22 ' A' ' 86' ' ' LEU . 36.7 m80 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.546 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.86 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.679 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.66 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.698 HD13 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' HG13 ' A' ' 30' ' ' ILE . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.463 HD11 ' HE1' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HA ' ' HE3' ' A' ' 26' ' ' MET . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.648 HG22 ' HG3' ' A' ' 55' ' ' MET . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.734 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.499 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.653 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.557 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.648 ' HG3' HG22 ' A' ' 43' ' ' VAL . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.636 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.754 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.448 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 61' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.754 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.815 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 70' ' ' SER . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.698 HD23 HD13 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.45 HD22 ' CE1' ' A' ' 12' ' ' HIS . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 1.017 HD11 ' HA ' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.66 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.53 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 13.1 Cg_exo -70.24 -147.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.96 111.44 19.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.037 0.446 . . . . 0.0 111.25 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 m -95.72 73.46 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.884 0.85 . . . . 0.0 109.749 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.9 t -89.0 115.03 26.26 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.706 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 t -94.02 -33.79 13.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.246 0.92 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.263 179.083 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.051 -0.419 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -82.14 162.75 17.81 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.594 2.196 . . . . 0.0 112.682 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -92.0 98.28 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.683 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 169.04 42.83 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.16 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 48.6 m -104.15 77.37 1.42 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.705 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm -103.72 140.64 37.32 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 121.709 -0.62 . . . . 0.0 109.424 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.705 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.69 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 1.015 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.066 ' HG ' HD12 ' A' ' 20' ' ' ILE . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 1.066 HD12 ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.634 HG23 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.634 ' H ' HG23 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.697 HD13 HD23 ' A' ' 75' ' ' LEU . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.725 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.725 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 28' ' ' HIS . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.871 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 38' ' ' SER . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 36' ' ' THR . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.661 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.644 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.564 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.602 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.912 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.644 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.912 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.656 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.773 HD11 HG21 ' A' ' 20' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.871 ' HE1' HD21 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.519 HG23 ' HE1' ' A' ' 1' ' ' MET . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.415 HD23 ' O ' ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' C ' ' HE2' ' A' ' 1' ' ' MET . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.706 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.576 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.846 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HE2' HD13 ' A' ' 9' ' ' LEU . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.485 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.697 HD23 HD13 ' A' ' 25' ' ' ILE . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.605 ' CD2' HD11 ' A' ' 25' ' ' ILE . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.658 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.688 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.786 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.595 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 7.5 t-160 -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.623 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.86 -7.23 20.11 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.558 ' H ' HG22 ' A' ' 91' ' ' ILE . 57.7 t -79.59 98.99 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.148 0.499 . . . . 0.0 109.985 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.1 p -135.62 38.4 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.617 1.198 . . . . 0.0 109.219 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.4 p -83.64 -71.42 0.5 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.637 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.9 m -125.07 86.14 2.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.572 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.452 -0.785 . . . . 0.0 110.273 -179.704 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 N-CA-C 112.152 -0.379 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -87.3 123.11 1.86 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.281 2.654 . . . . 0.0 112.543 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 8.3 mp -106.42 97.4 7.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.969 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -110.68 -77.23 0.9 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.486 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.683 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 49.4 m -140.52 157.52 45.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.813 0.339 . . . . 0.0 110.568 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.634 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -76.5 -166.03 0.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 -179.62 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.542 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.813 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 1.018 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.409 ' C ' ' H ' ' A' ' 13' ' ' ARG . 58.8 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.64 HD11 HG21 ' A' ' 57' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.604 HD13 HG12 ' A' ' 57' ' ' ILE . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.575 ' H ' HG23 ' A' ' 22' ' ' THR . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.601 HD13 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.762 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.615 ' HB3' HD13 ' A' ' 35' ' ' LEU . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.762 HD11 ' HE2' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.555 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.722 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 37' ' ' ILE . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.632 ' HD3' HD22 ' A' ' 45' ' ' ASN . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.576 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.632 HD22 ' HD3' ' A' ' 42' ' ' LYS . 29.6 p30 -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.526 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.628 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.722 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.571 HG22 ' HE3' ' A' ' 1' ' ' MET . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.683 ' O ' ' HA ' ' A' ' -1' ' ' SER . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.855 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.855 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.601 HD23 HD13 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.579 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.531 ' CD2' HD11 ' A' ' 25' ' ' ILE . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.579 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.627 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.782 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.475 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo -84.28 37.57 0.64 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.1 t -116.68 113.66 43.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 m -113.17 53.86 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.22 0.533 . . . . 0.0 111.807 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.5 m -116.4 34.45 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.39 0.614 . . . . 0.0 110.466 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.4 p -109.2 114.66 28.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.082 0.467 . . . . 0.0 111.435 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.773 -1.108 . . . . 0.0 109.648 179.52 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -56.48 123.86 14.87 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.757 2.305 . . . . 0.0 112.182 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 tt -71.03 116.63 11.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.082 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -141.07 137.32 8.09 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.486 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 27.8 p -148.4 163.73 36.24 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.524 0.19 . . . . 0.0 110.79 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.8 OUTLIER -77.03 163.64 26.49 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.554 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.528 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 13' ' ' ARG . 65.4 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.91 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.91 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.777 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.416 ' O ' HD12 ' A' ' 25' ' ' ILE . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.881 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.573 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.855 HD13 HD23 ' A' ' 75' ' ' LEU . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.55 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 30' ' ' ILE . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.714 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.533 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.485 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.811 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.881 ' HG2' HG21 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.811 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.593 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 60' ' ' ILE . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.786 HG21 HD11 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 55' ' ' MET . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 56' ' ' LEU . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.651 ' O ' ' HA ' ' A' ' -1' ' ' SER . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.525 ' O ' ' HE3' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.651 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.572 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.757 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 65' ' ' ASN . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.645 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.855 HD23 HD13 ' A' ' 25' ' ' ILE . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.439 ' HD2' HD11 ' A' ' 25' ' ' ILE . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.602 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.645 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.522 HG23 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo -73.71 -72.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.01 170.14 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.064 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.9 m -102.88 101.8 12.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.377 0.608 . . . . 0.0 110.631 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 23.1 p -52.41 121.63 7.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.33 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.0 m -105.01 -168.17 1.44 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.97 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.229 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.6 139.58 44.92 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.821 2.347 . . . . 0.0 112.86 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -88.36 151.29 22.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.74 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -126.51 84.65 0.34 Allowed Glycine 0 C--N 1.32 -0.348 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.712 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 9.5 t -158.04 -156.56 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.357 0.598 . . . . 0.0 110.585 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.779 ' HB3' ' HD3' ' A' ' 6' ' ' ARG . 29.6 ttm -101.62 177.63 4.86 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.373 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.923 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.779 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.942 ' HA ' HD11 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.906 ' HA ' HD13 ' A' ' 16' ' ' LEU . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.919 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.919 HD12 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.479 ' HA ' HD22 ' A' ' 56' ' ' LEU . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.63 HD13 HD23 ' A' ' 75' ' ' LEU . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.744 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.464 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' N ' ' A' ' 71' ' ' PHE . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD2' ' HB2' ' A' ' 70' ' ' SER . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.96 HD21 ' HE1' ' A' ' 59' ' ' MET . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.726 HG22 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 5.6 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.471 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.576 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 58' ' ' LYS . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.726 ' HG3' HG22 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 22' ' ' THR . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.626 ' HA ' HD12 ' A' ' 60' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.96 ' HE1' HD21 ' A' ' 35' ' ' LEU . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 57' ' ' ILE . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 10' ' ' LEU . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.577 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.498 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.923 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.526 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.628 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.63 HD23 HD13 ' A' ' 25' ' ' ILE . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.464 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.9 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.557 ' CD2' HD11 ' A' ' 25' ' ' ILE . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.628 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.701 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo -64.48 -62.05 0.1 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.1 t -104.57 104.39 16.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 t -79.14 73.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.432 0.634 . . . . 0.0 110.86 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 79.5 p -132.0 163.32 28.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.1 m -134.28 44.31 2.71 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.041 0.448 . . . . 0.0 110.38 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.164 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.697 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 30.0 ttm . . . . . 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.814 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.697 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.003 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.622 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.873 HD12 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.784 ' HA ' HD22 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.684 HD11 ' CD2' ' A' ' 80' ' ' TYR . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.746 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.82 HD21 ' HE1' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.726 HE21 ' HB2' ' A' ' 53' ' ' ALA . 1.7 tp60 -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.535 HE21 ' HG3' ' A' ' 51' ' ' GLN . 27.4 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HG3' HE21 ' A' ' 50' ' ' GLN . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.727 ' HG2' HG21 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.726 ' HB2' HE21 ' A' ' 49' ' ' GLN . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.43 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.686 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.784 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 HG21 ' A' ' 20' ' ' ILE . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.82 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.675 ' O ' HG23 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.739 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.814 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.485 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.535 HD23 HD13 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.684 ' CD2' HD11 ' A' ' 25' ' ' ILE . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.643 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.485 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 1.003 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.794 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.491 HD11 ' CE2' ' A' ' 68' ' ' TYR . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.548 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm . . . . . 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.461 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.901 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' A' ' 61' ' ' LEU . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.3 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 1.0 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.0 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.578 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.578 ' H ' HG23 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.491 ' H ' ' HD1' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' A' ' 80' ' ' TYR . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.758 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.751 HD21 ' HE1' ' A' ' 59' ' ' MET . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HG3' HD13 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.639 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.856 HG22 ' HG3' ' A' ' 55' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.407 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.55 ' O ' ' HB2' ' A' ' 55' ' ' MET . 49.2 tp60 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.713 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.856 ' HG3' HG22 ' A' ' 43' ' ' VAL . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 22' ' ' THR . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.713 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.751 ' HE1' HD21 ' A' ' 35' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.471 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.65 ' O ' HG23 ' A' ' 69' ' ' VAL . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 1.025 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 65' ' ' ASN . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.534 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CG ' HD11 ' A' ' 25' ' ' ILE . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.511 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.491 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.901 HD11 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 87' ' ' LEU . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo . . . . . 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.631 ' SD ' ' HG2' ' A' ' 6' ' ' ARG . 32.8 ttm . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.532 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.896 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.949 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.566 ' HA ' HD13 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.644 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.44 ' HB2' HD23 ' A' ' 83' ' ' LEU . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.644 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.513 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 22' ' ' THR . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.593 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.835 HD11 ' HD2' ' A' ' 80' ' ' TYR . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.781 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.781 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.855 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.52 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 52' ' ' ARG . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.2 m120 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.449 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' A' ' 50' ' ' GLN . 1.9 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 55' ' ' MET . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.799 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.588 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 22' ' ' THR . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.799 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.855 ' HE1' HD21 ' A' ' 35' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 ' HE1' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.472 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.882 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.896 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.514 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' HA ' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.8 HD23 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.835 ' HD2' HD11 ' A' ' 25' ' ' ILE . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.514 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.949 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 87' ' ' LEU . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.526 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.757 ' HA ' HD22 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.631 HD23 ' HG ' ' A' ' 16' ' ' LEU . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.619 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.644 HD11 HD13 ' A' ' 57' ' ' ILE . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.733 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.733 HG22 ' HA ' ' A' ' 17' ' ' GLU . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.608 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.589 HD13 HD23 ' A' ' 75' ' ' LEU . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.663 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.413 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.772 HD13 ' HB2' ' A' ' 35' ' ' LEU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.663 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.772 ' HB2' HD13 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.527 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.584 ' HG2' HD22 ' A' ' 35' ' ' LEU . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.633 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.633 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.468 HD22 ' HA ' ' A' ' 45' ' ' ASN . 2.9 m120 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.611 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' GLN . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.472 HE21 ' HB3' ' A' ' 50' ' ' GLN . 2.9 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.785 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.659 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.659 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.438 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.866 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.654 ' O ' HG23 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.645 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 77' ' ' HIS . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 25' ' ' ILE . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.495 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.477 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.517 HD11 ' CE2' ' A' ' 68' ' ' TYR . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo . . . . . 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.571 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.809 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.511 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.849 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.447 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 37.7 m-70 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.506 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' O ' ' A' ' 9' ' ' LEU . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.791 ' HA ' HG22 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.74 HG23 ' H ' ' A' ' 23' ' ' SER . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.74 ' H ' HG23 ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.57 HD13 HD23 ' A' ' 75' ' ' LEU . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.704 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.559 ' HB3' HD13 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.704 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.688 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.884 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.523 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HB2' HD13 ' A' ' 30' ' ' ILE . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.445 HG22 ' HG3' ' A' ' 55' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.2 m120 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.718 HE21 ' HG3' ' A' ' 51' ' ' GLN . 16.5 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.718 ' HG3' HE21 ' A' ' 50' ' ' GLN . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.703 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.713 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 22' ' ' THR . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.703 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.676 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.688 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.809 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.587 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.402 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.57 HD23 HD13 ' A' ' 25' ' ' ILE . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.56 ' CD1' HD11 ' A' ' 25' ' ' ILE . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.662 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.849 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.542 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.4 t-160 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.58 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.566 HG23 HG22 ' A' ' 69' ' ' VAL . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 72.8 Cg_endo . . . . . 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.447 ' CE ' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm . . . . . 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.627 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.861 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.616 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.883 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.714 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.958 HG21 ' HG2' ' A' ' 52' ' ' ARG . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.638 ' H ' HG23 ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.767 HD13 HD23 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.747 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.678 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.678 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.605 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.555 HD11 ' HE1' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.708 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.708 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.423 ' HB2' HD13 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.709 HG22 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.516 HD22 ' HA ' ' A' ' 45' ' ' ASN . 0.3 OUTLIER -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.742 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.742 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.958 ' HG2' HG21 ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.705 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.522 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.709 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.705 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.68 ' HG3' ' O ' ' A' ' 55' ' ' MET . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.528 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.605 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.747 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.767 HD23 HD13 ' A' ' 25' ' ' ILE . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.576 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.861 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.661 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.8 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.562 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.986 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.884 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 1.031 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.431 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.031 HD13 ' HA ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.933 HD12 ' HG ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.706 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.544 HD13 HD23 ' A' ' 75' ' ' LEU . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.701 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.414 ' HB3' HD13 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.701 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.919 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' HB2' HD13 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.523 HG22 ' HG3' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.603 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.78 HE21 ' HB3' ' A' ' 53' ' ' ALA . 6.6 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.414 HE21 ' HG3' ' A' ' 51' ' ' GLN . 28.7 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.603 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.623 ' HB3' HG21 ' A' ' 22' ' ' THR . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.78 ' HB3' HE21 ' A' ' 49' ' ' GLN . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.706 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.655 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.919 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.986 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.605 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.44 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.544 HD23 HD13 ' A' ' 25' ' ' ILE . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 25' ' ' ILE . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.884 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.699 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 21.7 Cg_exo . . . . . 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.801 ' HE1' HG23 ' A' ' 60' ' ' ILE . 30.3 ttm . . . . . 0 N--CA 1.444 -0.757 0 CA-C-O 120.861 0.362 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.903 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.639 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.484 HD21 HG22 ' A' ' 57' ' ' ILE . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.8 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.83 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.83 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.983 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.765 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.794 HD13 HD23 ' A' ' 75' ' ' LEU . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.765 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.765 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.842 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.773 HG22 ' HG3' ' A' ' 55' ' ' MET . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 1.0 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.486 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.7 OUTLIER -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.672 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 25.8 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.983 ' HG2' HG21 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.773 ' HG3' HG22 ' A' ' 43' ' ' VAL . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.641 HD12 ' HE1' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.684 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.842 ' HE1' HD21 ' A' ' 35' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.801 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.413 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.903 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.685 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.408 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.659 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.927 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.542 ' CD2' HD11 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.927 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.577 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.659 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.749 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo . . . . . 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 1.012 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.573 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.699 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.721 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HG ' ' A' ' 16' ' ' LEU . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.573 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.609 ' CD2' HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.609 HD12 ' CD2' ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.679 HG23 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG23 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.648 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.498 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.483 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.693 HD13 ' HB2' ' A' ' 40' ' ' GLU . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.561 ' HB3' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.561 ' HD1' ' HB3' ' A' ' 32' ' ' ASP . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.534 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.693 ' HB2' HD13 ' A' ' 30' ' ' ILE . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.439 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.686 HE21 ' HG2' ' A' ' 51' ' ' GLN . 32.4 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.686 ' HG2' HE21 ' A' ' 50' ' ' GLN . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.738 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.627 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD12 ' CE ' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.627 ' HG3' ' O ' ' A' ' 55' ' ' MET . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.445 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.507 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.62 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 1.012 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.495 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.648 HD23 HD13 ' A' ' 25' ' ' ILE . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD11 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.687 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.721 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.468 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.606 HG23 HG22 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo . . . . . 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.504 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.496 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.449 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.52 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.815 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.747 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.954 ' HG ' HD12 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.954 HD12 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' H ' HD12 ' A' ' 25' ' ' ILE . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.733 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD23 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.437 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.928 HD21 ' HE1' ' A' ' 59' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.485 ' HB2' HD13 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.614 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.727 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.503 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.727 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 98.9 mm-40 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 22' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.666 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.733 HD22 ' HA ' ' A' ' 22' ' ' THR . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.746 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.928 ' HE1' HD21 ' A' ' 35' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 59' ' ' MET . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.775 ' O ' HG23 ' A' ' 69' ' ' VAL . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.869 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 65' ' ' ASN . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.495 ' CE2' ' HB1' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.592 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.495 ' HB1' ' CE2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.815 HD11 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.529 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.57 ' HG3' ' HA ' ' A' ' 65' ' ' ASN . 24.5 ttm . . . . . 0 N--CA 1.432 -1.326 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 65' ' ' ASN . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.791 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.03 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.786 ' HA ' HD13 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.527 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 14' ' ' GLU . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.786 HD13 ' HA ' ' A' ' 10' ' ' LEU . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.558 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG21 HG12 ' A' ' 57' ' ' ILE . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.596 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.563 ' H ' HG23 ' A' ' 22' ' ' THR . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.84 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.777 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.509 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.514 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 35' ' ' LEU . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.887 ' HB2' HD13 ' A' ' 30' ' ' ILE . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.639 ' HB2' HD12 ' A' ' 30' ' ' ILE . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.638 HG22 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.495 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.845 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.893 HE21 ' HG3' ' A' ' 51' ' ' GLN . 14.4 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.893 ' HG3' HE21 ' A' ' 50' ' ' GLN . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.845 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.742 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.649 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.791 HG12 HG21 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.649 ' HG3' ' O ' ' A' ' 55' ' ' MET . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.438 HG23 ' HE1' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.511 ' O ' ' HE2' ' A' ' 1' ' ' MET . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.69 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.626 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.791 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.69 HG23 ' O ' ' A' ' 65' ' ' ASN . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.418 ' HE2' HD13 ' A' ' 9' ' ' LEU . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.692 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.84 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.858 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CD1' HD11 ' A' ' 25' ' ' ILE . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.858 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 1.03 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.549 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.1 t-160 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.549 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 6.1 Cg_exo . . . . . 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.674 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.674 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.965 ' HA ' HD11 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.737 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' A' ' 13' ' ' ARG . 3.4 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' HG22 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.567 HD12 HD12 ' A' ' 16' ' ' LEU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.764 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.711 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.614 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.727 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.769 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.727 HD11 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.769 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.528 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.464 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.532 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.558 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.614 HE21 ' HG3' ' A' ' 51' ' ' GLN . 19.0 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' HE21 ' A' ' 50' ' ' GLN . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.707 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 55' ' ' MET . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 57' ' ' ILE . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.707 HD12 ' HA ' ' A' ' 58' ' ' LYS . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.834 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.788 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HZ ' HD11 ' A' ' 20' ' ' ILE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.487 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.614 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.965 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.416 HD13 ' CE2' ' A' ' 68' ' ' TYR . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.597 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 87' ' ' LEU . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.677 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.4 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.889 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.02 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.02 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HB2' ' HE2' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.694 HG23 ' H ' ' A' ' 23' ' ' SER . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.694 ' H ' HG23 ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.724 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.76 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.995 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 48' ' ' THR . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.976 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.995 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.976 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.76 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.517 HD12 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.737 HD11 HG21 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.611 ' HG3' ' O ' ' A' ' 55' ' ' MET . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 57' ' ' ILE . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.409 ' O ' ' HE2' ' A' ' 1' ' ' MET . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.727 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.735 ' OH ' ' HB3' ' A' ' 87' ' ' LEU . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 65' ' ' ASN . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.635 ' HE2' HD13 ' A' ' 9' ' ' LEU . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.508 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.694 ' HE2' ' HB2' ' A' ' 21' ' ' LYS . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 83' ' ' LEU . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.735 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.543 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 87' ' ' LEU . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo . . . . . 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.807 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.559 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.634 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.734 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.734 ' HG ' HD23 ' A' ' 10' ' ' LEU . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' HG22 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 17' ' ' GLU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.497 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.548 ' HA ' HD22 ' A' ' 56' ' ' LEU . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.688 HD13 HD23 ' A' ' 75' ' ' LEU . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.67 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.633 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.67 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.633 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.542 ' HG2' HD22 ' A' ' 35' ' ' LEU . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HG2' ' A' ' 55' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.413 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.3 m120 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.497 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.697 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.548 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.697 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 62' ' ' LYS . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.697 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.807 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.402 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.694 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.688 HD23 HD13 ' A' ' 25' ' ' ILE . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.497 ' OH ' ' HD2' ' A' ' 21' ' ' LYS . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.629 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.694 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.73 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.544 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.919 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.544 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.959 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.825 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.8 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.461 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.825 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.533 HD12 ' HG ' ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.817 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.733 HD13 HD23 ' A' ' 75' ' ' LEU . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.411 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.595 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 30' ' ' ILE . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 37' ' ' ILE . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.646 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 1.004 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.585 HG22 ' HG3' ' A' ' 55' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.484 HD22 ' HA ' ' A' ' 45' ' ' ASN . 0.5 OUTLIER -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.474 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.738 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.648 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.677 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.677 ' HG3' ' O ' ' A' ' 55' ' ' MET . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.723 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.919 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.607 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.445 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HD13 ' A' ' 25' ' ' ILE . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.624 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.577 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.624 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 83' ' ' LEU . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.959 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.617 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.547 HG23 HG22 ' A' ' 69' ' ' VAL . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 5.1 ptp . . . . . 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.815 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.421 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.017 ' HA ' HD11 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.86 ' HA ' HD13 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.4 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.546 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.86 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.679 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.66 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.698 HD13 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' HG13 ' A' ' 30' ' ' ILE . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.463 HD11 ' HE1' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HA ' ' HE3' ' A' ' 26' ' ' MET . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.74 ' HA ' HD22 ' A' ' 45' ' ' ASN . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.648 HG22 ' HG3' ' A' ' 55' ' ' MET . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.74 HD22 ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.499 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.653 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.557 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.648 ' HG3' HG22 ' A' ' 43' ' ' VAL . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.636 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.754 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.448 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 61' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.754 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.815 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 70' ' ' SER . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.698 HD23 HD13 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 83' ' ' LEU . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 1.017 HD11 ' HA ' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.66 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.53 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 13.1 Cg_exo . . . . . 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.705 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.705 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.69 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 1.015 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.066 ' HG ' HD12 ' A' ' 20' ' ' ILE . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 1.066 HD12 ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.634 HG23 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.634 ' H ' HG23 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.697 HD13 HD23 ' A' ' 75' ' ' LEU . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.725 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.725 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 28' ' ' HIS . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.871 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 38' ' ' SER . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 36' ' ' THR . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.661 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.644 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.564 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.602 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.897 HE21 ' HG3' ' A' ' 51' ' ' GLN . 26.7 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.912 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 39.4 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.644 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.912 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.656 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.773 HD11 HG21 ' A' ' 20' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.871 ' HE1' HD21 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.519 HG23 ' HE1' ' A' ' 1' ' ' MET . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.415 HD23 ' O ' ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' C ' ' HE2' ' A' ' 1' ' ' MET . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.706 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.576 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.846 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HE2' HD13 ' A' ' 9' ' ' LEU . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.485 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.697 HD23 HD13 ' A' ' 25' ' ' ILE . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.605 ' CD2' HD11 ' A' ' 25' ' ' ILE . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.658 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.688 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.786 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.595 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 7.5 t-160 -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.623 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo . . . . . 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.634 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.542 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.813 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 1.018 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.409 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.3 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.64 HD11 HG21 ' A' ' 57' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.604 HD13 HG12 ' A' ' 57' ' ' ILE . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.575 ' H ' HG23 ' A' ' 22' ' ' THR . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.601 HD13 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.762 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.615 ' HB3' HD13 ' A' ' 35' ' ' LEU . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.762 HD11 ' HE2' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.555 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.722 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 37' ' ' ILE . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.576 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.595 ' C ' HD22 ' A' ' 45' ' ' ASN . 0.1 OUTLIER -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.587 ' N ' HD22 ' A' ' 45' ' ' ASN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.526 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.628 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.722 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.571 HG22 ' HE3' ' A' ' 1' ' ' MET . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.495 ' HB2' ' HA ' ' A' ' 60' ' ' ILE . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.855 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.855 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.601 HD23 HD13 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.579 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.531 ' CD2' HD11 ' A' ' 25' ' ' ILE . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.579 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.627 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.782 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.475 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.554 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.528 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.91 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.91 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.777 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.416 ' O ' HD12 ' A' ' 25' ' ' ILE . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.881 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.573 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.855 HD13 HD23 ' A' ' 75' ' ' LEU . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.55 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 30' ' ' ILE . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.714 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.533 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.485 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.811 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.881 ' HG2' HG21 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.811 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.593 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 60' ' ' ILE . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.786 HG21 HD11 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 55' ' ' MET . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 56' ' ' LEU . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.525 ' O ' ' HE3' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.651 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.572 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.757 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 65' ' ' ASN . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.645 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.855 HD23 HD13 ' A' ' 25' ' ' ILE . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.439 ' HD2' HD11 ' A' ' 25' ' ' ILE . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.602 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.645 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.522 HG23 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo . . . . . 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.779 ' HB3' ' HD3' ' A' ' 6' ' ' ARG . 29.6 ttm . . . . . 0 N--CA 1.443 -0.801 0 CA-C-O 120.946 0.403 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.923 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.779 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.942 ' HA ' HD11 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.906 ' HA ' HD13 ' A' ' 16' ' ' LEU . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.919 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.919 HD12 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.479 ' HA ' HD22 ' A' ' 56' ' ' LEU . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.63 HD13 HD23 ' A' ' 75' ' ' LEU . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.744 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.464 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' N ' ' A' ' 71' ' ' PHE . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD2' ' HB2' ' A' ' 70' ' ' SER . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.96 HD21 ' HE1' ' A' ' 59' ' ' MET . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.726 HG22 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 9.2 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.512 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.471 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.576 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 58' ' ' LYS . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.726 ' HG3' HG22 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 22' ' ' THR . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.626 ' HA ' HD12 ' A' ' 60' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.96 ' HE1' HD21 ' A' ' 35' ' ' LEU . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 57' ' ' ILE . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 10' ' ' LEU . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.577 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.498 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.923 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.526 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.628 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.63 HD23 HD13 ' A' ' 25' ' ' ILE . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.464 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.557 ' CD2' HD11 ' A' ' 25' ' ' ILE . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.628 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.701 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo . . . . . 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.941 0 N-CA-C 112.065 -0.414 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.52 120.41 7.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.901 2.401 . . . . 0.0 112.337 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.4 pp -117.69 147.46 42.91 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.499 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 69.34 28.82 72.18 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.144 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.1 m -69.35 172.71 6.68 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 122.349 -0.501 . . . . 0.0 110.123 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.697 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 30.0 ttm -67.17 124.49 23.24 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.253 0.549 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.3 t70 -67.53 139.52 56.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.909 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.23 -47.0 88.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.879 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . 24.1 tptm -62.68 -37.59 87.03 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.814 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.66 -61.45 1.81 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.569 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.697 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 1.1 ttm180 -54.72 -33.73 61.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.936 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -73.11 -49.44 28.43 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-O 119.245 -0.407 . . . . 0.0 111.178 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 95.5 m -51.98 -26.32 10.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.206 0.527 . . . . 0.0 110.571 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.003 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.94 -58.25 3.26 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.862 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 16' ' ' LEU . 77.1 mt -75.18 -37.87 61.05 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.3 tt0 -59.29 -32.59 70.18 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.935 0.494 . . . . 0.0 110.808 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 36.5 m-70 -82.05 43.84 0.81 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.016 0.913 . . . . 0.0 109.144 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 2.7 ppt_? -64.49 -5.41 5.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 113.758 -1.565 . . . . 0.0 108.71 177.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 12' ' ' HIS . 10.8 mt-10 -61.87 -33.18 73.73 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 176.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.63 -4.89 5.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.873 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -49.28 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.851 0.357 . . . . 0.0 111.44 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -55.78 -28.99 58.87 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.932 0.396 . . . . 0.0 112.053 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.622 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.3 OUTLIER -72.77 -40.36 66.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -177.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -119.15 -14.54 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.873 HD12 ' HG ' ' A' ' 16' ' ' LEU . 15.1 mt -70.47 104.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.833 178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 80' ' ' TYR . 12.9 mptt -92.78 166.86 12.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.717 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.784 ' HA ' HD22 ' A' ' 56' ' ' LEU . 11.3 t -123.47 -12.26 7.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.0 m -64.83 -92.58 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -67.17 -28.65 68.28 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.684 HD11 ' CD2' ' A' ' 80' ' ' TYR . 65.8 mt -59.46 -42.74 88.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.746 ' O ' HG13 ' A' ' 30' ' ' ILE . 56.4 ttp -74.3 -29.66 61.73 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.42 -42.02 99.14 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -71.4 -26.48 62.79 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.401 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 47.0 mtp -78.92 -34.01 44.96 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.666 0.269 . . . . 0.0 111.658 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -77.28 -39.09 27.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 60.0 p -69.01 -26.48 65.03 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 10.2 t70 -71.3 -24.88 62.22 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.71 3.03 62.73 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.751 -0.738 . . . . 0.0 113.368 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.5 m-85 -85.63 -32.22 22.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.223 0.535 . . . . 0.0 110.373 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.82 HD21 ' HE1' ' A' ' 59' ' ' MET . 3.4 mp -98.22 116.14 29.83 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.22 177.2 9.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.668 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 59.1 mt -61.15 -34.92 62.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 42.8 t -66.01 -43.47 87.58 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 1.5 mp0 -59.64 -50.01 75.52 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 70.4 tt0 -56.39 -44.69 80.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.628 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.8 tp10 -57.0 -53.09 62.0 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.086 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 38' ' ' SER . 50.0 mttt -55.52 -56.73 16.88 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.0 t -57.33 -45.81 85.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -73.8 -23.51 59.69 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -60.8 -38.97 87.19 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 51.9 mm-40 -63.35 144.67 97.5 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.886 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 12.3 Cg_exo -74.97 -41.98 0.59 Allowed 'Trans proline' 0 N--CA 1.481 0.756 0 C-N-CA 123.245 2.63 . . . . 0.0 117.197 -175.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 39.8 p -132.31 178.33 6.9 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.515 -177.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.726 HE21 ' HB2' ' A' ' 53' ' ' ALA . 1.7 tp60 -53.47 -19.73 3.97 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 121.312 0.577 . . . . 0.0 110.32 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.535 HE21 ' HG3' ' A' ' 51' ' ' GLN . 27.4 tt0 -47.83 -80.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.309 178.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.535 ' HG3' HE21 ' A' ' 50' ' ' GLN . 75.3 mt-30 -87.71 -11.32 48.59 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.886 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.727 ' HG2' HG21 ' A' ' 22' ' ' THR . 1.4 ttp180 -71.03 -59.49 2.75 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.726 ' HB2' HE21 ' A' ' 49' ' ' GLN . . . -64.41 -40.95 96.78 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.43 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.7 -33.16 72.45 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.848 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.686 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.0 tpt -73.75 -37.03 65.2 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 121.385 -0.126 . . . . 0.0 110.748 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.784 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.1 tp -60.72 -49.79 76.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 HG21 ' A' ' 20' ' ' ILE . 17.7 mt -65.7 -35.19 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.589 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 24.7 ttmm -66.21 -30.56 71.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.685 -0.688 . . . . 0.0 111.057 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.82 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.3 mtm -68.33 -47.23 68.07 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 56' ' ' LEU . 6.0 mm -57.24 -26.59 26.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 114.133 -1.394 . . . . 0.0 110.397 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 58' ' ' LYS . 0.9 OUTLIER -53.25 -32.19 47.15 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.815 178.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.29 50.46 1.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.431 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 10.8 tptt -107.58 -128.5 0.27 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 45.7 m-20 -150.45 175.76 11.57 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.881 0.764 . . . . 0.0 110.815 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.675 ' O ' HG23 ' A' ' 69' ' ' VAL . 18.8 t-20 -56.37 -47.1 79.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.983 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.84 -50.09 69.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.396 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.739 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -68.57 -33.27 73.77 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.725 0.298 . . . . 0.0 110.942 -179.711 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.814 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 6.4 t80 -67.91 -42.88 80.43 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.887 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 65' ' ' ASN . 10.9 t -66.37 -27.97 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.6 t -70.75 -51.75 25.17 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.12 -37.55 69.58 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.474 0.654 . . . . 0.0 109.236 177.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.485 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 32.4 t80 -61.02 -51.95 67.07 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.171 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.06 -34.11 74.38 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.884 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.99 -33.12 75.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.66 0.267 . . . . 0.0 110.376 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.535 HD23 HD13 ' A' ' 25' ' ' ILE . 86.2 mt -64.27 -40.41 95.92 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.642 -0.874 . . . . 0.0 108.642 177.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -68.38 -23.69 64.7 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.416 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.83 -25.23 58.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.398 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 3.7 mm-40 -116.68 38.04 3.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.1 21.04 44.97 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 115.806 1.082 . . . . 0.0 115.806 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.684 ' CD2' HD11 ' A' ' 25' ' ' ILE . 24.3 m-85 -101.88 50.87 0.84 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.111 0.955 . . . . 0.0 109.756 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -67.23 -31.27 71.52 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.399 -1.273 . . . . 0.0 111.891 -178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -64.71 -50.8 65.53 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.643 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -61.39 -47.77 84.29 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.485 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -59.04 -36.45 75.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.236 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.38 84.09 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 83' ' ' LEU . 46.4 mt -62.32 -22.38 66.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.238 177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 1.003 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.8 OUTLIER -100.84 -16.78 17.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.414 -178.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -55.9 -23.54 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.057 0.543 . . . . 0.0 111.29 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.35 -41.06 88.32 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.362 0.601 . . . . 0.0 109.725 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.794 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -84.83 -22.7 52.35 Favored Glycine 0 N--CA 1.442 -0.921 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.576 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.617 HG22 HG22 ' A' ' 93' ' ' VAL . 11.3 mm -80.13 113.27 37.21 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 117.141 0.471 . . . . 0.0 110.148 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -80.81 24.29 0.68 Allowed 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.018 2.478 . . . . 0.0 114.662 -177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.617 HG22 HG22 ' A' ' 91' ' ' ILE . 31.7 m -132.93 158.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 O-C-N 121.842 -0.536 . . . . 0.0 111.456 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.5 t -124.97 70.04 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.5 t 77.35 -70.68 0.12 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.016 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 62.72 22.97 13.69 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.587 -179.831 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 112.293 -0.323 . . . . 0.0 112.293 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -86.33 177.96 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.724 2.282 . . . . 0.0 112.329 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -129.32 151.64 49.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.955 0.407 . . . . 0.0 110.698 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 178.68 -170.23 42.08 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.099 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.2 p -125.1 -114.81 0.29 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.058 0.456 . . . . 0.0 111.163 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.548 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 46.8 ttm -99.31 156.81 16.8 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.0 132.46 38.99 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.889 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -65.64 -33.5 76.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.56 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 tttt -72.98 -33.63 65.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 1.025 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.2 -59.91 2.6 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.171 177.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.461 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 47.5 ttp180 -56.66 -30.46 63.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.194 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 5.6 m-20 -76.12 -46.48 28.61 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 116.673 -0.239 . . . . 0.0 110.771 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 87.2 m -58.01 -20.86 41.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.207 0.527 . . . . 0.0 110.197 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.901 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -80.66 -61.95 1.82 Allowed 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.79 178.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' A' ' 61' ' ' LEU . 39.1 mt -75.71 -27.06 58.05 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' A' ' 13' ' ' ARG . 5.3 tt0 -65.46 -34.04 77.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.921 0.391 . . . . 0.0 109.989 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -80.11 36.8 0.36 Allowed 'General case' 0 C--O 1.217 -0.622 0 CA-C-O 121.378 0.608 . . . . 0.0 109.744 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.607 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 10.8 tpt180 -47.78 -31.13 4.55 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.323 1.449 . . . . 0.0 112.118 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -66.15 -24.19 66.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.049 0.452 . . . . 0.0 110.294 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.29 -13.81 11.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.724 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.607 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 29.1 tp -44.8 -82.29 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.939 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 1.0 ' HA ' HG22 ' A' ' 20' ' ' ILE . 35.7 tt0 -56.75 -28.19 60.74 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -37.46 78.04 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.5 29.1 5.12 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.0 HG22 ' HA ' ' A' ' 17' ' ' GLU . 13.1 tt -120.03 37.82 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-O 123.077 1.418 . . . . 0.0 109.104 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -76.53 141.57 41.15 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.767 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.578 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -66.29 -102.09 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 114.4 -1.273 . . . . 0.0 112.732 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.578 ' H ' HG23 ' A' ' 22' ' ' THR . 75.7 m 29.09 -101.94 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.491 ' H ' ' HD1' ' A' ' 24' ' ' TYR . 6.5 m-85 -55.35 -62.65 1.53 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -178.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.53 HD11 ' CG ' ' A' ' 80' ' ' TYR . 79.7 mt -50.67 -48.33 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.142 -0.935 . . . . 0.0 112.408 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.758 ' O ' HG13 ' A' ' 30' ' ' ILE . 25.5 ttt -69.74 -20.91 63.49 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -71.34 -35.98 71.36 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.9 m-70 -73.04 -33.04 65.46 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 31.7 mtp -71.64 -38.67 70.7 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 26' ' ' MET . 18.4 mt -75.55 -43.93 41.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.58 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 t -66.69 -26.37 66.99 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.62 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 36.3 t0 -70.14 -29.8 66.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -1.8 47.2 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.008 -1.091 . . . . 0.0 113.676 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -79.42 -25.2 42.1 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.725 0.774 . . . . 0.0 109.568 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.751 HD21 ' HE1' ' A' ' 59' ' ' MET . 5.6 mp -109.8 116.17 31.18 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 33.8 p -84.86 173.94 10.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.533 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 50.3 mm -60.0 -35.47 61.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.684 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -74.71 -30.17 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.521 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 29.0 mt-10 -74.1 -37.12 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HG3' HD13 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -68.36 -46.61 69.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.495 177.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -35.84 -67.92 0.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.138 -1.392 . . . . 0.0 113.942 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.639 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 39.8 tttm -65.95 -47.32 75.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -177.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.856 HG22 ' HG3' ' A' ' 55' ' ' MET . 22.0 t -56.19 -42.49 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 121.308 0.575 . . . . 0.0 111.316 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -78.83 -29.03 44.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.523 -178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -79.64 -18.18 52.08 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.639 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 49.3 mm-40 -56.89 150.28 39.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 120.722 0.296 . . . . 0.0 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.42 -64.41 0.21 Allowed 'Trans proline' 0 N--CA 1.475 0.423 0 C-N-CA 123.678 2.919 . . . . 0.0 115.109 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.407 ' HB ' ' H ' ' A' ' 49' ' ' GLN . 6.5 p -143.25 -165.87 2.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.49 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.407 ' H ' ' HB ' ' A' ' 48' ' ' THR . 0.7 OUTLIER -45.9 -27.28 0.84 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 123.818 0.699 . . . . 0.0 111.189 179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -41.47 -87.03 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 O-C-N 124.548 1.155 . . . . 0.0 111.168 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.55 ' O ' ' HB2' ' A' ' 55' ' ' MET . 49.2 tp60 -90.81 -5.68 55.3 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.58 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.541 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 31.5 ttm180 -72.63 -58.04 3.67 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.713 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -69.97 -41.73 74.09 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.84 -32.44 70.69 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.098 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.856 ' HG3' HG22 ' A' ' 43' ' ' VAL . 16.9 tpt -71.11 -35.82 71.91 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 22' ' ' THR . 18.1 tp -61.94 -51.69 67.09 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.713 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.6 mt -62.16 -31.56 51.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.119 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.88 -39.26 79.9 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.411 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.751 ' HE1' HD21 ' A' ' 35' ' ' LEU . 4.8 mtm -60.53 -55.27 35.44 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 23.5 mt -57.52 -39.38 68.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.53 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 7.0 tt -51.07 -37.88 48.32 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 123.525 0.516 . . . . 0.0 110.382 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 tttm -124.66 39.03 4.07 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.814 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 64' ' ' ASP . 14.8 mmtt -94.0 -120.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.471 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 1.8 p30 -161.28 174.71 13.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.379 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.65 ' O ' HG23 ' A' ' 69' ' ' VAL . 11.1 t-20 -58.12 -44.34 87.68 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 123.684 0.615 . . . . 0.0 110.854 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -57.99 -49.64 76.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.807 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 63' ' ' LYS . 0.7 OUTLIER -70.71 -27.26 63.85 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.16 -0.616 . . . . 0.0 110.313 179.668 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 1.025 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 15.8 t80 -69.49 -44.5 70.97 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.509 -178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 65' ' ' ASN . 14.7 t -67.13 -27.58 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.4 t -72.6 -47.68 45.93 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 t80 -58.41 -38.59 77.69 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.534 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 91.7 t80 -60.28 -46.37 90.09 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.414 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -58.4 -42.72 87.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.315 -1.311 . . . . 0.0 110.557 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.24 -31.75 72.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.341 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 25' ' ' ILE . 84.0 mt -68.12 -34.53 76.53 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -83.58 -17.17 42.61 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.654 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -72.18 -24.47 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.44 ' HA ' ' OE1' ' A' ' 78' ' ' GLU . 47.8 mm-40 -116.8 -139.45 0.37 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.052 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -117.81 48.39 0.95 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.173 -1.013 . . . . 0.0 112.396 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.53 ' CG ' HD11 ' A' ' 25' ' ' ILE . 2.9 m-85 -124.28 39.9 3.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.503 0.668 . . . . 0.0 109.265 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -74.69 -22.15 59.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.841 -177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.511 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 39.1 t70 -73.42 -42.34 62.16 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.971 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.597 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.55 -45.87 88.53 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.14 -39.21 81.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.152 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.491 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -63.38 -32.78 74.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 83' ' ' LEU . 56.1 mt -64.62 -28.09 69.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.507 0.67 . . . . 0.0 109.65 177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.901 HD11 ' HA ' ' A' ' 9' ' ' LEU . 5.2 mp -97.7 -10.39 25.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.385 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.8 t-160 -57.93 -23.57 54.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.513 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.21 -13.17 62.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.982 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -115.21 -17.89 6.52 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' VAL . 46.8 mm -73.71 130.71 83.07 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -45.09 -42.02 16.16 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.039 3.159 . . . . 0.0 115.254 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.6 m -79.71 76.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.607 0.718 . . . . 0.0 112.317 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.502 HG13 ' O ' ' A' ' 91' ' ' ILE . 4.2 m -102.42 49.89 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.28 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 94' ' ' VAL . 40.7 t 74.56 -62.79 0.45 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.197 0.599 . . . . 0.0 110.168 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.7 m -81.72 138.23 35.25 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.182 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.604 -0.712 . . . . 0.0 109.965 179.783 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.22 -179.46 5.28 Favored 'Trans proline' 0 CA--C 1.53 0.3 0 C-N-CA 122.616 2.211 . . . . 0.0 112.18 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -109.27 111.36 22.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.162 0.506 . . . . 0.0 109.688 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 89.59 85.33 1.32 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.038 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 39.2 m -124.74 -174.92 3.14 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.631 ' SD ' ' HG2' ' A' ' 6' ' ' ARG . 32.8 ttm -63.82 126.32 27.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.123 0.487 . . . . 0.0 110.556 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.532 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 8.2 t70 -66.69 144.24 56.49 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.503 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.01 -37.9 84.18 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.219 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 1.1 mptm? -65.48 -42.01 92.67 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.896 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.1 -51.56 56.84 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.998 0.904 . . . . 0.0 109.018 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 5.6 mmm-85 -56.65 -35.5 68.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.589 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 -84.32 -49.69 8.51 Favored 'General case' 0 C--O 1.208 -1.087 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.85 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 75.6 m -54.5 -22.01 11.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 118.606 0.639 . . . . 0.0 110.246 178.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.949 ' HA ' HD11 ' A' ' 87' ' ' LEU . 7.0 tp -78.53 -61.83 1.88 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.23 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.566 ' HA ' HD13 ' A' ' 16' ' ' LEU . 29.6 mt -81.46 -30.01 33.54 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -61.11 -33.98 74.24 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.391 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -85.38 40.51 0.84 Allowed 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.77 177.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 3.3 tpp180 -54.32 -25.48 24.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.271 -1.332 . . . . 0.0 111.55 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 pm0 -67.49 -22.71 65.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.528 0.68 . . . . 0.0 109.244 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.21 -22.07 11.13 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.503 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.644 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 1.3 tp -44.76 -84.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 O-C-N 123.821 0.701 . . . . 0.0 110.859 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.32 -30.62 2.15 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 123.731 0.644 . . . . 0.0 112.636 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -60.64 -50.4 73.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.752 -178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.44 ' HB2' HD23 ' A' ' 83' ' ' LEU . 58.1 m-20 -101.52 -35.14 9.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.173 0.511 . . . . 0.0 111.313 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.644 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.27 123.66 16.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 122.039 0.923 . . . . 0.0 111.234 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -158.47 156.31 30.09 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.559 -1.2 . . . . 0.0 108.651 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.513 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.8 OUTLIER -82.4 -101.77 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 22' ' ' THR . 14.3 m 49.21 -111.86 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.593 ' HA ' ' HB3' ' A' ' 27' ' ' ASP . 2.2 m-85 -82.72 -24.91 33.37 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.835 HD11 ' HD2' ' A' ' 80' ' ' TYR . 75.5 mt -63.63 -34.83 70.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.781 ' O ' HG13 ' A' ' 30' ' ' ILE . 63.1 ttp -85.25 -29.2 24.83 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.872 177.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 24' ' ' TYR . 4.1 t70 -61.84 -40.93 97.03 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.579 0.704 . . . . 0.0 110.495 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 78.4 m-70 -74.42 -23.51 58.95 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.656 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ILE . 43.2 mtp -79.78 -35.05 39.19 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 179.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.781 HG13 ' O ' ' A' ' 26' ' ' MET . 13.3 mt -72.55 -47.38 51.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.9 m -67.21 -26.13 66.46 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.698 178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.713 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 19.6 t70 -68.41 -28.4 67.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.68 0.41 55.34 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.22 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -87.51 -19.06 28.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.499 0.666 . . . . 0.0 109.961 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.855 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.8 mp -117.78 123.75 46.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.661 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 22.5 p -91.08 169.67 10.66 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.115 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 63.1 mt -57.99 -34.41 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.517 0.199 . . . . 0.0 110.509 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.4 t -69.34 -37.96 77.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.112 0.482 . . . . 0.0 109.913 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.86 -37.46 73.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.52 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 21.0 tt0 -67.42 -45.65 75.48 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.947 177.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -45.5 -62.53 1.24 Allowed 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 114.704 -1.135 . . . . 0.0 112.949 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -57.21 -44.83 84.07 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.446 HG13 ' O ' ' A' ' 52' ' ' ARG . 62.6 t -59.5 -48.63 86.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.271 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 15.6 ptm180 -73.6 -22.09 60.13 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.401 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.2 m120 -68.7 -34.82 76.31 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.294 -0.254 . . . . 0.0 111.284 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -64.88 144.98 99.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -79.61 -29.06 3.09 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.535 2.157 . . . . 0.0 116.862 -175.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.449 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -144.99 170.27 16.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.587 1.085 . . . . 0.0 112.11 -178.299 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -38.21 -30.49 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.741 1.276 . . . . 0.0 112.436 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' A' ' 50' ' ' GLN . 1.9 tt0 -41.02 -92.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 O-C-N 124.356 1.035 . . . . 0.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 55' ' ' MET . 2.0 mt-30 -91.54 -2.66 57.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.892 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 48' ' ' THR . 0.3 OUTLIER -77.01 -56.71 4.34 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.799 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -71.48 -42.44 68.08 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -56.07 -32.59 64.24 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.876 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.588 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.7 tpt -68.75 -43.57 75.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 22' ' ' THR . 17.0 tp -60.77 -50.17 74.55 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 122.094 0.949 . . . . 0.0 109.817 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.799 HG12 ' O ' ' A' ' 53' ' ' ALA . 5.9 mm -67.8 -20.65 26.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.934 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -79.9 -34.95 38.64 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.944 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.855 ' HE1' HD21 ' A' ' 35' ' ' LEU . 7.8 mtm -59.14 -49.18 78.87 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 ' HE1' ' A' ' 1' ' ' MET . 32.9 mt -58.42 -38.2 68.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.759 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.472 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.7 tt -56.76 -26.23 56.98 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.513 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.0 36.55 4.57 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.468 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' MET . 55.8 mttm -127.18 -163.2 1.23 Allowed 'General case' 0 N--CA 1.454 -0.253 0 O-C-N 122.155 -0.341 . . . . 0.0 110.216 178.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -122.81 174.33 7.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 120.578 0.228 . . . . 0.0 110.853 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.882 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 15.6 p30 -60.86 -19.59 60.29 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.05 -52.23 65.85 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.24 -28.41 57.14 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 121.461 0.648 . . . . 0.0 109.499 178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.896 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 45.7 t80 -64.24 -44.49 91.67 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.329 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 65' ' ' ASN . 83.7 t -68.82 -33.93 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 178.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.3 t -66.74 -46.12 76.46 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.38 -43.16 92.93 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.514 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 42.7 t80 -57.53 -48.34 79.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.784 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -57.41 -39.35 75.99 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.669 179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' HA ' ' A' ' 25' ' ' ILE . . . -66.17 -34.87 79.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.023 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.8 HD23 HD13 ' A' ' 25' ' ' ILE . 60.9 mt -64.83 -28.96 69.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 10.0 mp -85.15 -18.54 33.84 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.653 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -71.33 -44.64 64.71 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -92.64 -140.2 0.2 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.498 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -120.27 52.44 0.73 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 119.538 -1.315 . . . . 0.0 114.353 -177.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.835 ' HD2' HD11 ' A' ' 25' ' ' ILE . 59.8 m-85 -133.39 48.31 2.39 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.918 0.866 . . . . 0.0 110.761 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 86.0 mttt -74.89 -12.57 60.39 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.295 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -73.45 -51.33 17.6 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -60.49 -43.69 96.72 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 177.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.514 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -58.31 -39.2 78.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.36 178.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.21 -37.82 88.51 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 83' ' ' LEU . 77.9 mt -61.13 -23.86 65.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.342 0.591 . . . . 0.0 110.28 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.949 HD11 ' HA ' ' A' ' 9' ' ' LEU . 9.0 mp -106.66 -1.14 23.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.089 -178.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 21.6 t-160 -61.94 -29.93 70.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.96 0.41 . . . . 0.0 110.112 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.31 -20.97 64.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.138 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.434 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.23 -16.39 35.22 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.628 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.587 HG12 ' O ' ' A' ' 87' ' ' LEU . 49.4 mm -82.26 117.2 67.57 Favored Pre-proline 0 C--N 1.331 -0.231 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.26 -83.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.592 2.194 . . . . 0.0 112.613 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 6.2 m -144.5 162.11 14.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-O 121.726 0.774 . . . . 0.0 112.653 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 9.5 m -134.47 125.82 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.9 m -69.16 81.88 0.34 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.238 -177.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.7 p 43.24 76.36 0.08 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.84 0.856 . . . . 0.0 112.821 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.253 1.252 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.238 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.032 0 N-CA-C 111.945 -0.462 . . . . 0.0 111.945 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -77.17 64.84 7.89 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 123.189 2.593 . . . . 0.0 112.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 19.6 tp -85.79 143.03 28.52 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 78.84 179.45 51.63 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.704 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 14.3 p -151.7 -165.2 2.17 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.526 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -87.92 -178.73 6.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.164 0.507 . . . . 0.0 111.049 179.583 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -66.94 136.14 54.89 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.24 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.49 -34.29 77.86 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.273 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? -65.58 -45.41 83.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.645 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -65.66 -53.35 42.47 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -53.42 -38.27 63.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 m-20 -74.56 -47.48 32.42 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.1 m -53.44 -21.79 6.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 118.852 0.751 . . . . 0.0 110.095 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.757 ' HA ' HD22 ' A' ' 87' ' ' LEU . 7.9 tp -81.09 -63.22 1.45 Allowed 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.833 178.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.631 HD23 ' HG ' ' A' ' 16' ' ' LEU . 20.1 mt -84.64 -24.12 29.22 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -176.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.458 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -67.03 -31.16 71.51 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -83.19 39.23 0.64 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.619 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 19.7 tpp180 -50.49 -26.55 5.28 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.801 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -58.52 -28.81 65.79 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.684 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -120.99 -15.09 8.34 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.061 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.644 HD11 HD13 ' A' ' 57' ' ' ILE . 2.3 tm? -46.63 -84.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.134 0.574 . . . . 0.0 111.311 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.733 ' HA ' HG22 ' A' ' 20' ' ' ILE . 78.2 tt0 -57.25 -26.22 60.41 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -67.13 -40.67 86.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -108.21 -20.88 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.733 HG22 ' HA ' ' A' ' 17' ' ' GLU . 5.2 tt -68.66 113.2 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.332 1.063 . . . . 0.0 110.181 -178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.3 tttt -108.99 168.49 9.32 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.559 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.608 ' CG2' ' HA ' ' A' ' 53' ' ' ALA . 19.1 p -113.88 -89.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 m -8.91 -77.88 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -73.33 -44.05 59.63 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -177.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.589 HD13 HD23 ' A' ' 75' ' ' LEU . 53.6 mt -56.91 -43.48 80.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.406 0.622 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.759 ' O ' HG12 ' A' ' 30' ' ' ILE . 10.9 tmm? -71.41 -31.35 67.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.214 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.3 -36.98 85.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.595 0.712 . . . . 0.0 109.335 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.663 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 75.9 m-70 -69.4 -28.32 66.06 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.59 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.413 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.9 mtp -78.04 -34.43 50.54 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.809 0.338 . . . . 0.0 111.665 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.772 HD13 ' HB2' ' A' ' 35' ' ' LEU . 6.2 mm -73.6 -45.69 50.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -66.37 -24.27 66.47 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.299 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.663 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 4.9 t0 -70.69 -28.92 65.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.75 -1.3 59.75 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.375 -0.917 . . . . 0.0 113.013 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -80.88 -37.15 30.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.162 0.506 . . . . 0.0 110.194 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.772 ' HB2' HD13 ' A' ' 30' ' ' ILE . 77.7 mt -98.41 135.03 40.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 177.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 39.3 p -94.54 -172.37 2.74 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.631 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.527 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.0 mp -66.48 -26.31 37.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.446 ' O ' ' HG3' ' A' ' 42' ' ' LYS . 18.8 m -70.85 -39.85 72.7 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.461 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.584 ' HG2' HD22 ' A' ' 35' ' ' LEU . 14.9 mp0 -70.34 -44.86 67.32 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.633 ' HG2' ' HD2' ' A' ' 44' ' ' ARG . 39.3 tt0 -60.19 -49.16 78.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.496 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.5 tp10 -51.87 -50.02 61.78 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.93 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 38' ' ' SER . 63.3 mttp -58.52 -57.69 11.86 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.7 t -53.74 -39.07 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.527 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.633 ' HD2' ' HG2' ' A' ' 40' ' ' GLU . 40.0 mtp85 -76.45 -31.2 57.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.468 HD22 ' HA ' ' A' ' 45' ' ' ASN . 2.9 m120 -55.52 -43.65 75.94 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.035 0.445 . . . . 0.0 110.734 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -62.18 138.4 96.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.696 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 7.8 Cg_exo -76.38 -38.97 0.88 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 123.146 2.564 . . . . 0.0 115.576 -176.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.611 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 32.9 p -127.02 170.98 11.75 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.88 -0.728 . . . . 0.0 111.378 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' GLN . 7.8 tt0 -52.07 -21.67 3.42 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.887 0.742 . . . . 0.0 110.847 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.472 HE21 ' HB3' ' A' ' 50' ' ' GLN . 2.9 tt0 -43.46 -83.89 0.01 OUTLIER 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.591 0.756 . . . . 0.0 111.21 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 14.4 mm100 -89.29 -11.22 44.11 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.396 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.611 ' HB3' ' O ' ' A' ' 48' ' ' THR . 4.7 ttp180 -71.36 -53.26 14.74 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 120.111 -0.636 . . . . 0.0 109.438 178.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.785 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.6 -44.75 77.35 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.29 -31.45 65.65 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 123.206 0.316 . . . . 0.0 110.787 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.659 ' O ' ' HG3' ' A' ' 59' ' ' MET . 9.4 tpt -68.59 -39.74 80.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.7 tp -61.98 -53.44 55.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.785 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.5 mt -61.94 -27.06 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.043 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -75.72 -39.35 57.47 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 122.862 0.465 . . . . 0.0 111.143 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.659 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.9 mtm -56.24 -52.19 65.37 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.438 ' O ' ' HE3' ' A' ' 1' ' ' MET . 1.9 mp -61.49 -41.74 91.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.684 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 tp -58.6 -29.0 66.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.901 0.381 . . . . 0.0 110.515 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.866 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.4 OUTLIER -113.54 37.85 3.1 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.037 0.446 . . . . 0.0 110.834 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -132.17 -157.23 0.8 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.39 174.98 6.4 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.654 ' O ' HG23 ' A' ' 69' ' ' VAL . 14.0 p30 -62.31 -22.39 66.01 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.766 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.85 -49.82 76.22 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 m -75.26 -26.83 59.13 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.123 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.645 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 2.1 t80 -69.1 -40.15 78.55 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.679 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 65' ' ' ASN . 46.2 t -69.75 -30.42 44.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.7 t -68.52 -47.76 66.14 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -59.61 -38.47 81.36 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 37.4 t80 -59.23 -48.24 82.35 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.034 0.921 . . . . 0.0 108.764 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.53 -40.18 82.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.324 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 77' ' ' HIS . . . -64.26 -32.29 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.817 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 25' ' ' ILE . 98.3 mt -66.38 -39.82 89.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.1 mp -70.43 -23.96 62.82 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.62 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.495 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 13.0 m-70 -71.7 -29.77 64.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.9 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -119.66 39.21 3.68 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.31 17.27 61.5 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -104.89 53.25 0.73 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 119.008 1.404 . . . . 0.0 110.09 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -75.87 -13.95 60.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.751 -1.113 . . . . 0.0 113.131 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.52 -41.75 26.67 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.611 0.641 . . . . 0.0 110.385 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -65.09 -46.55 80.66 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 177.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.26 -31.53 71.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.704 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -66.28 -35.15 79.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 78.0 mt -63.15 -36.16 82.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.274 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.757 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.4 OUTLIER -85.26 -17.07 38.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.806 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 10.5 t-160 -59.02 -15.89 15.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.41 0.624 . . . . 0.0 110.186 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.18 -33.99 74.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.007 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.477 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.16 -17.33 20.65 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 113.102 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.517 HD11 ' CE2' ' A' ' 68' ' ' TYR . 1.7 mp -85.58 131.86 46.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.019 0.438 . . . . 0.0 111.136 -179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.3 Cg_exo -61.32 165.04 13.63 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 122.819 2.346 . . . . 0.0 112.436 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 6.9 p -78.92 120.72 30.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 111.69 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.31 54.38 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 122.097 0.951 . . . . 0.0 108.778 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 30.6 t -135.98 87.49 2.31 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.029 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.0 m -87.1 84.18 7.33 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.863 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.702 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.919 0 N-CA-C 112.442 -0.263 . . . . 0.0 112.442 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -82.91 45.66 1.96 Allowed 'Trans proline' 0 CA--C 1.534 0.488 0 C-N-CA 123.098 2.532 . . . . 0.0 113.111 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 59.6 tp -69.4 114.31 7.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 84.31 86.51 0.89 Allowed Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 -178.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 32.9 m -129.87 159.72 35.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.006 0.432 . . . . 0.0 111.531 -178.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.571 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.7 pmm? -99.64 -172.75 2.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -76.68 138.93 40.33 Favored 'General case' 0 C--N 1.318 -0.767 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.314 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.58 -44.15 87.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.012 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HE2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 tptm -66.07 -43.24 87.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.809 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -61.16 -58.45 8.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.343 178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.9 ttm180 -56.68 -35.18 68.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.399 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -75.66 -47.18 27.42 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.762 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.511 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 67.3 m -54.76 -21.37 10.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.538 0.685 . . . . 0.0 109.954 177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.849 ' HA ' HD11 ' A' ' 87' ' ' LEU . 3.9 tp -79.13 -62.78 1.59 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.274 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.423 ' N ' ' HG ' ' A' ' 9' ' ' LEU . 56.5 mt -80.76 -18.73 46.73 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -177.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -74.67 -30.29 61.53 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.103 0.478 . . . . 0.0 109.755 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.447 ' HD2' ' O ' ' A' ' 8' ' ' CYS . 37.7 m-70 -81.81 36.29 0.44 Allowed 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.506 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 1.2 mmt180 -46.94 -34.82 5.84 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.963 1.305 . . . . 0.0 112.076 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -61.85 -22.99 65.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.19 0.519 . . . . 0.0 110.178 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.1 -16.27 11.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD13 ' O ' ' A' ' 9' ' ' LEU . 17.2 tp -50.85 -88.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 123.378 0.671 . . . . 0.0 112.196 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.791 ' HA ' HG22 ' A' ' 20' ' ' ILE . 14.4 tt0 -54.4 -23.14 14.5 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -60.41 -47.77 84.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.892 0.377 . . . . 0.0 111.131 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.63 -34.34 6.75 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' HA ' ' A' ' 17' ' ' GLU . 3.1 tt -55.83 128.01 15.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.353 0.597 . . . . 0.0 110.133 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -144.99 -171.55 3.66 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.21 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.74 HG23 ' H ' ' A' ' 23' ' ' SER . 4.9 t -120.5 -103.29 0.41 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 118.979 -0.534 . . . . 0.0 111.461 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.74 ' H ' HG23 ' A' ' 22' ' ' THR . 9.7 t 30.45 -101.36 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.78 -49.19 78.47 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.57 HD13 HD23 ' A' ' 75' ' ' LEU . 92.2 mt -55.84 -41.8 68.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.356 0.598 . . . . 0.0 110.27 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.704 ' O ' HG13 ' A' ' 30' ' ' ILE . 11.6 ttt -72.47 -24.36 61.18 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.217 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -72.43 -32.04 65.98 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.671 0.748 . . . . 0.0 109.549 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -77.32 -30.09 53.91 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.427 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.559 ' HB3' HD13 ' A' ' 35' ' ' LEU . 17.1 mtp -73.04 -35.36 66.71 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.565 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.704 HG13 ' O ' ' A' ' 26' ' ' MET . 19.7 mt -78.63 -38.0 21.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.7 t -66.8 -27.48 67.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.016 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -70.84 -29.22 65.29 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.35 -2.23 57.58 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.899 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.688 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-30 -78.85 -31.94 45.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.607 0.717 . . . . 0.0 109.523 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.884 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.0 mp -98.89 111.6 23.94 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.0 p -82.64 -176.75 6.42 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.53 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 42.4 mt -62.7 -27.83 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.4 t -71.35 -46.95 59.27 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.624 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.523 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -61.65 -41.59 97.74 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HB2' HD13 ' A' ' 30' ' ' ILE . 32.5 tt0 -62.42 -50.75 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.919 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -49.85 -56.85 8.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.395 -0.82 . . . . 0.0 113.122 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -60.62 -49.87 75.79 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.445 HG22 ' HG3' ' A' ' 55' ' ' MET . 59.2 t -58.15 -42.95 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.899 0.381 . . . . 0.0 110.582 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.5 ttm-85 -77.94 -15.68 58.79 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.909 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.2 m120 -76.26 -37.44 57.59 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 122.165 -0.334 . . . . 0.0 111.535 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . 4.2 mm-40 -54.23 143.94 42.56 Favored Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.018 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 51.7 Cg_exo -56.04 -62.6 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 123.495 2.797 . . . . 0.0 116.405 -176.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 74.8 p -127.17 -180.0 5.15 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.506 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 14.1 tt0 -48.67 -26.26 2.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.912 0.758 . . . . 0.0 110.219 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.718 HE21 ' HG3' ' A' ' 51' ' ' GLN . 16.5 tt0 -42.79 -73.37 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.771 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.718 ' HG3' HE21 ' A' ' 50' ' ' GLN . 80.2 mt-30 -88.95 -14.93 35.51 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.993 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 48' ' ' THR . 13.0 ttt85 -67.07 -60.04 2.96 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.336 0.588 . . . . 0.0 109.448 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.703 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.36 -43.48 77.34 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.875 178.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.665 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -56.91 -37.02 70.84 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.782 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.713 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.4 tpt -65.43 -37.4 86.8 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 22' ' ' THR . 9.9 tp -64.26 -53.02 55.67 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.703 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.3 mt -58.88 -39.22 77.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-O 121.722 0.772 . . . . 0.0 109.709 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 8.6 tppt? -67.77 -32.74 73.54 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.189 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.884 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.1 mtm -61.23 -51.29 69.6 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.09 -36.07 37.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.497 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.0 tt -57.88 -35.04 70.45 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.73 36.76 2.53 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.284 0.564 . . . . 0.0 112.07 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 59' ' ' MET . 70.0 mmtt -123.78 -145.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.8 p-10 -143.03 -174.68 4.25 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.964 0.412 . . . . 0.0 112.102 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.676 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.4 t-20 -54.82 -48.23 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.928 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -53.06 -50.68 63.85 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.381 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.688 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -72.29 -31.04 65.38 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.898 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.809 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 4.9 t80 -68.27 -39.66 82.1 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.965 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.3 t -69.3 -28.15 37.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.7 t -70.34 -50.11 42.41 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.28 -40.05 76.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 177.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.587 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 25.2 t80 -59.11 -47.75 84.12 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.471 177.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -58.24 -39.3 78.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.062 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.402 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.84 -33.95 76.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.904 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.57 HD23 HD13 ' A' ' 25' ' ' ILE . 36.4 mt -65.5 -32.28 73.81 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.198 0.523 . . . . 0.0 109.794 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -81.66 -17.11 49.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.468 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -75.05 -31.36 61.26 Favored 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -108.05 -144.63 0.39 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.606 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -110.19 50.05 0.8 Allowed Glycine 0 CA--C 1.52 0.393 0 C-N-CA 119.922 -1.132 . . . . 0.0 114.472 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.56 ' CD1' HD11 ' A' ' 25' ' ' ILE . 43.6 m-85 -132.75 44.33 2.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 117.684 0.742 . . . . 0.0 110.702 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 58.0 pttt -73.63 -19.28 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.805 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.62 -47.08 50.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.662 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -63.12 -45.75 90.55 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.205 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.55 -41.17 80.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.352 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.45 -36.35 82.14 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 83' ' ' LEU . 75.8 mt -60.94 -30.0 69.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.278 0.561 . . . . 0.0 109.993 177.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.849 HD11 ' HA ' ' A' ' 9' ' ' LEU . 2.9 mp -91.87 -19.08 22.88 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.789 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.542 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.4 t-160 -60.49 -16.67 39.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.804 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -61.84 -32.16 72.47 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.406 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.58 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -101.32 -13.29 33.58 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.513 -0.767 . . . . 0.0 113.263 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.566 HG23 HG22 ' A' ' 69' ' ' VAL . 26.2 mm -84.38 110.27 25.55 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 117.27 0.535 . . . . 0.0 111.288 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 72.8 Cg_endo -77.84 -22.09 10.55 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.777 2.318 . . . . 0.0 112.43 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.3 t -79.91 128.32 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.6 p -116.43 80.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.898 0.856 . . . . 0.0 111.211 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.5 m -74.19 90.54 2.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.176 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 39.3 t -101.96 -40.73 6.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.256 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.888 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.413 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.413 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 16.5 Cg_exo -68.67 -32.99 22.68 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.157 2.572 . . . . 0.0 113.512 -179.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.95 -34.3 33.31 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.493 0.663 . . . . 0.0 110.687 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 144.46 117.24 1.14 Allowed Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.177 -1.011 . . . . 0.0 113.02 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.6 p -166.07 -155.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.447 ' CE ' ' HB2' ' A' ' 68' ' ' TYR . 36.1 ttm -100.45 155.94 17.55 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.14 132.45 40.0 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.66 70.39 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.403 0.439 . . . . 0.0 112.018 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -64.87 -36.31 83.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.884 0.373 . . . . 0.0 110.393 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.03 -58.46 4.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.173 0.511 . . . . 0.0 110.348 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.627 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 2.0 tmm_? -56.41 -35.13 67.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.101 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m-20 -77.32 -51.16 11.34 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-O 118.851 -0.595 . . . . 0.0 111.9 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.26 -23.12 5.19 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 118.882 0.764 . . . . 0.0 110.419 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.861 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.4 tp -74.48 -61.34 1.9 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.114 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.616 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.5 mt -84.55 -14.74 48.05 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -71.67 -31.5 66.87 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -86.79 41.03 0.93 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.049 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.883 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.83 -25.07 7.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.357 178.273 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -55.15 -31.25 61.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.613 177.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.57 -18.7 10.85 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.798 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.1 tm? -49.44 -85.7 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.873 0.469 . . . . 0.0 110.89 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 1.3 tp10 -60.95 -19.84 61.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -78.03 -27.36 48.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -123.93 -41.78 2.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.535 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.714 ' HB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -51.52 134.11 12.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 121.53 0.681 . . . . 0.0 111.435 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mttt -149.96 -175.46 5.06 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.912 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.958 HG21 ' HG2' ' A' ' 52' ' ' ARG . 2.3 t -120.43 -104.06 0.4 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.083 -178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.638 ' H ' HG23 ' A' ' 22' ' ' THR . 12.2 m 44.48 -107.57 0.12 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -67.86 -37.55 81.98 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.767 HD13 HD23 ' A' ' 75' ' ' LEU . 58.0 mt -58.78 -44.7 90.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.4 0.619 . . . . 0.0 109.873 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.747 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.2 ttt -72.85 -23.86 60.81 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.479 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -71.57 -38.18 70.98 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.678 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.8 m-70 -72.07 -25.73 61.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.123 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 28.6 mtp -75.16 -33.02 61.44 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.883 0.373 . . . . 0.0 111.071 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 26' ' ' MET . 17.7 mt -78.52 -42.85 26.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 p -68.03 -21.66 65.01 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.678 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 2.2 t70 -71.97 -28.4 63.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.62 1.21 60.43 Favored Glycine 0 C--N 1.338 0.646 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.972 178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.605 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 4.1 m-85 -82.33 -35.68 27.66 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.249 0.547 . . . . 0.0 110.125 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.555 HD11 ' HE1' ' A' ' 59' ' ' MET . 68.2 mt -101.23 124.28 46.68 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 177.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.708 HG22 ' HG2' ' A' ' 39' ' ' GLU . 15.1 t -91.24 179.06 5.81 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 46.4 mm -56.38 -36.0 45.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.862 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.1 m -67.53 -35.7 79.58 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.751 0.31 . . . . 0.0 110.39 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.708 ' HG2' HG22 ' A' ' 36' ' ' THR . 4.2 mm-40 -69.94 -45.72 66.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.423 ' HB2' HD13 ' A' ' 30' ' ' ILE . 20.0 tt0 -60.87 -56.32 22.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.889 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -38.14 -56.72 1.15 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' HE2' ' A' ' 42' ' ' LYS . 6.7 ttmm -68.9 -50.29 50.82 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.709 HG22 ' HG3' ' A' ' 55' ' ' MET . 29.4 t -59.22 -36.16 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 121.355 0.598 . . . . 0.0 110.145 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.9 ttt-85 -82.77 -20.34 36.07 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.197 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.516 HD22 ' HA ' ' A' ' 45' ' ' ASN . 0.3 OUTLIER -65.73 -39.45 91.15 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.742 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 69.0 mm-40 -58.74 136.21 86.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.405 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 5.6 Cg_exo -82.38 -14.53 9.31 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 123.116 2.544 . . . . 0.0 115.337 -176.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 14.4 p -140.32 167.51 21.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 121.485 -0.759 . . . . 0.0 110.075 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -54.73 -20.34 8.18 Favored 'General case' 0 N--CA 1.461 0.12 0 O-C-N 123.537 0.523 . . . . 0.0 110.227 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -37.77 -84.38 0.0 OUTLIER 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.802 1.241 . . . . 0.0 110.789 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.742 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 2.0 mp0 -92.4 -6.79 49.33 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.077 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.958 ' HG2' HG21 ' A' ' 22' ' ' THR . 44.7 ttp180 -70.56 -54.08 13.5 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.705 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -70.22 -44.02 69.47 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.522 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -57.37 -40.79 78.86 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.696 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.709 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.0 tpt -65.14 -37.84 88.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -62.42 -53.66 51.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.705 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.5 mt -61.82 -30.62 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.983 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -72.58 -35.27 67.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.385 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.68 ' HG3' ' O ' ' A' ' 55' ' ' MET . 13.8 mtm -61.93 -50.92 70.24 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.528 ' HA ' ' HB2' ' A' ' 63' ' ' LYS . 15.6 mt -60.69 -28.81 43.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.262 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HA ' ' HD3' ' A' ' 6' ' ' ARG . 8.7 tt -58.32 -30.94 67.09 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -130.28 39.16 3.68 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.969 0.414 . . . . 0.0 111.927 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -101.05 -149.76 0.38 Allowed 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.846 -0.534 . . . . 0.0 109.715 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.71 162.11 19.59 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' ' 69' ' ' VAL . 24.9 t-20 -59.51 -41.56 90.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.356 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.53 -43.5 89.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.528 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.605 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -71.39 -28.82 64.29 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.077 0.465 . . . . 0.0 110.184 178.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.747 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 11.5 t80 -67.61 -42.52 82.26 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 65' ' ' ASN . 5.3 t -66.26 -28.3 43.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 44.2 t -70.44 -52.67 20.49 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 31.2 t80 -55.5 -38.94 69.82 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 73.6 t80 -57.36 -47.9 80.42 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.944 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -64.68 -37.44 87.58 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.379 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -35.52 81.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.286 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.767 HD23 HD13 ' A' ' 25' ' ' ILE . 76.2 mt -61.31 -44.34 97.37 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.11 -15.61 63.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.524 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -79.83 -38.18 33.42 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.159 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -109.62 35.59 3.28 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.512 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.71 30.86 68.0 Favored Glycine 0 CA--C 1.535 1.307 0 N-CA-C 116.789 1.476 . . . . 0.0 116.789 176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.576 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 1.3 m-85 -107.6 48.01 0.87 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.71 1.255 . . . . 0.0 109.492 178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.66 -29.41 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.476 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.03 -47.17 47.29 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.584 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.3 -45.75 92.27 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.23 -35.67 75.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.146 179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.83 -38.06 89.71 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 71.4 mt -61.65 -24.27 66.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.921 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.861 HD22 ' HA ' ' A' ' 9' ' ' LEU . 3.3 mt -98.72 -14.08 19.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.997 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -58.21 -21.51 48.17 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.076 0.55 . . . . 0.0 110.5 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.1 -23.97 64.99 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.545 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.661 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -102.22 -21.23 11.03 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.008 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 87' ' ' LEU . 34.8 mm -73.24 115.9 45.51 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 37.8 Cg_exo -61.89 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.047 2.498 . . . . 0.0 112.929 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.1 m -124.01 133.03 70.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.125 0.488 . . . . 0.0 111.881 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -156.6 39.15 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 122.808 1.289 . . . . 0.0 108.882 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.8 p -163.92 -176.78 4.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.248 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 m -76.51 117.39 18.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.864 -179.405 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.464 ' HA2' ' HD3' ' A' ' -4' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.062 -0.415 . . . . 0.0 112.062 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.464 ' HD3' ' HA2' ' A' ' -5' ' ' GLY . 83.1 Cg_endo -95.51 57.5 0.19 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 123.352 2.702 . . . . 0.0 112.95 -179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 21.6 tp -145.17 75.51 1.45 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.223 0.535 . . . . 0.0 110.499 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.51 79.67 0.26 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.607 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 60.2 m -155.88 172.03 19.05 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.562 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -78.13 -149.49 0.04 OUTLIER 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -80.89 127.03 32.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.331 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.97 -43.88 94.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.273 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -62.99 -41.15 99.49 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.986 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -68.86 -56.77 6.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.243 178.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' LEU . 39.1 ttp180 -54.5 -33.65 60.21 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.817 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -73.28 -46.34 50.35 Favored 'General case' 0 C--O 1.208 -1.081 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.938 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.0 m -55.34 -25.38 34.41 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.165 0.507 . . . . 0.0 109.978 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.884 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.6 tp -73.7 -61.18 1.93 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.831 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 1.031 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.8 mt -74.64 -32.04 62.15 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -178.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.431 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.2 tt0 -59.63 -35.7 74.89 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.044 0.538 . . . . 0.0 110.793 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -85.59 43.8 1.06 Allowed 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.995 0.902 . . . . 0.0 108.945 177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.779 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.16 -27.13 13.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 113.401 -1.727 . . . . 0.0 110.156 178.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -55.82 -30.05 60.77 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.478 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.64 -22.1 9.36 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.778 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.031 HD13 ' HA ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -54.73 -77.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.406 0.622 . . . . 0.0 110.98 179.031 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.66 -16.44 38.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.265 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -85.81 -42.88 13.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -122.78 -3.32 8.71 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.933 HD12 ' HG ' ' A' ' 16' ' ' LEU . 7.5 mt -73.95 89.4 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -78.91 133.11 36.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.171 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.706 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.8 t -97.16 0.63 48.7 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 p -87.31 -80.99 0.24 Allowed 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.549 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -55.75 -54.68 41.45 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.341 0.591 . . . . 0.0 112.19 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.544 HD13 HD23 ' A' ' 75' ' ' LEU . 96.7 mt -53.45 -42.67 49.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.234 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.701 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.1 ttp -70.28 -26.85 64.0 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.707 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -67.01 -29.94 69.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.732 0.777 . . . . 0.0 109.077 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 97.2 m-70 -79.65 -31.43 41.51 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.558 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.414 ' HB3' HD13 ' A' ' 35' ' ' LEU . 33.6 mtp -73.22 -35.4 66.31 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.701 HG13 ' O ' ' A' ' 26' ' ' MET . 17.2 mt -75.94 -39.35 37.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.6 t -67.44 -27.65 67.22 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 0.1 OUTLIER -69.08 -26.63 65.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.003 -0.999 . . . . 0.0 108.729 178.193 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.18 2.5 62.19 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.009 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 14.3 m-85 -85.62 -25.37 26.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.522 0.677 . . . . 0.0 109.914 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.919 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.0 mp -107.76 118.79 37.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.032 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 40.4 p -86.47 -177.19 6.12 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.917 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.4 mt -64.0 -32.01 55.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.331 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.5 p -75.19 -27.88 59.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.431 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 43' ' ' VAL . 56.9 mm-40 -75.98 -43.67 43.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' HB2' HD13 ' A' ' 30' ' ' ILE . 28.2 tt0 -59.87 -46.35 89.58 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.194 -0.912 . . . . 0.0 108.958 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.92 -62.48 1.11 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 114.107 -1.406 . . . . 0.0 113.054 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -60.66 -51.85 67.65 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.523 HG22 ' HG3' ' A' ' 55' ' ' MET . 19.1 t -59.49 -38.74 76.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.832 0.348 . . . . 0.0 110.796 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.9 ttp180 -80.58 -28.55 37.14 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.862 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -60.77 -41.0 94.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 121.318 -0.153 . . . . 0.0 111.18 -179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.603 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 62.8 mm-40 -65.26 139.42 97.5 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 121.014 0.435 . . . . 0.0 110.169 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.2 Cg_exo -83.2 -16.47 7.18 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.318 2.679 . . . . 0.0 116.723 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.2 p -138.51 169.89 16.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 120.215 1.371 . . . . 0.0 111.134 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.78 HE21 ' HB3' ' A' ' 53' ' ' ALA . 6.6 tm0? -49.91 -25.91 3.66 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.509 0.506 . . . . 0.0 110.546 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.414 HE21 ' HG3' ' A' ' 51' ' ' GLN . 28.7 tt0 -35.62 -85.82 0.0 OUTLIER 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 124.964 1.415 . . . . 0.0 111.064 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.603 ' CB ' ' HG3' ' A' ' 46' ' ' GLU . 46.9 mt-30 -90.86 -7.31 52.61 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.182 178.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.623 ' HB3' HG21 ' A' ' 22' ' ' THR . 18.9 mtm180 -69.07 -62.2 1.48 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.162 177.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.78 ' HB3' HE21 ' A' ' 49' ' ' GLN . . . -65.18 -41.43 94.62 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -60.89 -36.18 78.56 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.233 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.706 ' O ' ' HG3' ' A' ' 59' ' ' MET . 55.0 tpp -66.6 -42.82 86.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.072 0.396 . . . . 0.0 110.04 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.9 tp -61.04 -54.27 46.89 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.39 0.614 . . . . 0.0 109.974 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.655 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.0 mt -64.8 -25.52 37.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.959 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -77.87 -32.87 52.23 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.529 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.919 ' HE1' HD21 ' A' ' 35' ' ' LEU . 17.2 mtm -61.65 -51.06 70.0 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.4 mp -64.44 -30.03 49.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.588 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -51.3 -42.29 61.06 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -125.78 59.73 1.29 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.589 0.709 . . . . 0.0 110.541 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 5.7 tptm -118.4 -116.25 0.32 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 31.4 t70 -161.57 159.22 27.43 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 121.091 -0.243 . . . . 0.0 110.942 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' ' 69' ' ' VAL . 20.0 t-20 -48.43 -43.75 34.59 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 124.117 0.886 . . . . 0.0 110.85 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -58.08 -49.66 76.16 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -70.54 -27.0 63.82 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.094 0.473 . . . . 0.0 111.222 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.986 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 20.1 t80 -70.35 -42.28 72.06 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.533 -179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' ' 65' ' ' ASN . 16.2 t -69.8 -24.54 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.967 -1.124 . . . . 0.0 107.967 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 46.1 t -70.32 -53.58 16.18 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -56.24 -38.07 70.59 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.605 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 55.8 t80 -58.72 -49.54 77.22 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.491 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.98 -32.64 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.812 -1.086 . . . . 0.0 111.221 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.44 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -66.33 -34.18 77.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.343 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.544 HD23 HD13 ' A' ' 25' ' ' ILE . 54.8 mt -66.66 -33.24 75.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.8 mp -80.41 -19.74 45.55 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.483 178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 1.7 m-70 -72.19 -27.09 62.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -110.1 -144.19 0.39 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.006 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -112.79 44.27 1.54 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.057 -1.068 . . . . 0.0 113.222 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 25' ' ' ILE . 19.7 m-85 -126.03 51.74 1.75 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.508 0.67 . . . . 0.0 110.291 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -78.8 -17.72 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.396 -179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.456 ' O ' ' HG ' ' A' ' 86' ' ' LEU . 2.2 p30 -81.47 -32.77 32.35 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -69.0 -46.83 67.03 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.98 -34.16 74.35 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.474 178.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.56 84.6 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 30.6 mt -62.66 -28.05 69.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.086 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.884 HD11 ' HA ' ' A' ' 9' ' ' LEU . 4.3 mp -95.34 -14.6 23.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.378 -178.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -62.9 -18.4 62.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-O 121.62 0.724 . . . . 0.0 110.424 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.52 -18.43 65.04 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.281 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.699 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -110.35 -20.52 7.39 Favored Glycine 0 CA--C 1.522 0.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.323 179.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 50.7 mm -74.16 117.11 58.95 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.716 0.293 . . . . 0.0 111.277 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 21.7 Cg_exo -65.03 -72.12 0.02 OUTLIER 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.651 2.234 . . . . 0.0 111.877 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.13 135.68 47.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.129 0.49 . . . . 0.0 111.544 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.72 63.97 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 122.55 1.167 . . . . 0.0 109.345 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.0 m -89.47 -35.63 15.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.461 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.7 p -92.63 116.24 28.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.857 0.361 . . . . 0.0 110.501 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.202 -179.45 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.074 -0.411 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.27 74.18 5.28 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.46 2.106 . . . . 0.0 111.723 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.5 136.12 33.07 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.517 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -130.3 5.05 5.96 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.898 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 10.2 t -118.23 -137.51 0.35 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 120.769 0.319 . . . . 0.0 110.193 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.801 ' HE1' HG23 ' A' ' 60' ' ' ILE . 30.3 ttm -100.86 140.8 34.63 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 121.998 -0.439 . . . . 0.0 110.751 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -62.71 130.64 45.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.869 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.62 -39.4 88.08 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.478 0.486 . . . . 0.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -63.76 -34.57 78.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.886 0.375 . . . . 0.0 110.131 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.903 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -77.32 -55.64 5.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.408 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 61' ' ' LEU . 44.2 ttp180 -58.83 -26.83 64.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.677 -179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.8 m-20 -82.8 -49.18 9.99 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.751 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.639 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 27.7 p -54.35 -23.17 14.39 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.827 0.822 . . . . 0.0 110.48 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.691 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.6 tp -79.16 -63.09 1.5 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.206 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD21 HG22 ' A' ' 57' ' ' ILE . 51.8 mt -75.09 -28.96 60.48 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -177.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.8 tt0 -62.79 -33.12 74.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.876 0.47 . . . . 0.0 110.191 -179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -80.29 37.7 0.4 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.333 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.83 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 15.3 tpt180 -45.66 -35.51 4.19 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.178 1.391 . . . . 0.0 111.92 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 14' ' ' GLU . 36.1 tp10 -57.67 -28.64 63.95 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.907 0.384 . . . . 0.0 110.037 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -108.55 -20.08 13.22 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.83 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 1.3 tm? -48.33 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.865 0.866 . . . . 0.0 110.968 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.92 -15.77 34.79 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 14' ' ' GLU . 75.1 mttt -78.43 -45.33 22.53 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -113.19 -22.15 10.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 3.7 mt -63.78 110.52 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.384 0.611 . . . . 0.0 110.492 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -109.57 179.54 4.11 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.006 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.983 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.3 t -121.22 -86.45 0.65 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.962 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.765 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 m -3.95 -81.14 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 115.843 1.794 . . . . 0.0 115.843 -179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -63.05 -57.88 9.16 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.794 HD13 HD23 ' A' ' 75' ' ' LEU . 79.0 mt -53.04 -46.0 53.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.422 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.765 ' O ' HG13 ' A' ' 30' ' ' ILE . 46.0 ttp -65.48 -31.06 71.93 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.094 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -64.26 -34.27 77.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.765 0.793 . . . . 0.0 109.161 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -72.59 -33.32 66.65 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.491 178.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 30.5 mtp -68.49 -35.69 77.88 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.208 0.528 . . . . 0.0 111.036 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.765 HG13 ' O ' ' A' ' 26' ' ' MET . 5.3 mt -74.76 -36.59 40.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.8 t -67.61 -29.79 69.21 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.32 178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 38.6 m-20 -72.41 -25.66 61.57 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.309 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.35 4.78 62.38 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.984 178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.417 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 22.2 m-85 -84.75 -30.89 24.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.581 0.705 . . . . 0.0 109.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.842 HD21 ' HE1' ' A' ' 59' ' ' MET . 4.0 mp -104.15 128.04 51.8 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.4 p -89.9 179.33 6.0 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.979 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.4 -25.03 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 178.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.6 m -69.35 -39.45 78.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.632 177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 43' ' ' VAL . 4.1 mp0 -68.28 -47.13 68.48 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.57 -45.75 77.31 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.476 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 32.5 tt0 -53.22 -59.1 4.98 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.227 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 42' ' ' LYS . 10.1 mmpt? -62.83 -52.33 63.56 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -177.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.773 HG22 ' HG3' ' A' ' 55' ' ' MET . 31.0 t -55.96 -43.81 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-O 120.643 0.258 . . . . 0.0 111.172 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.17 -16.17 47.71 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 41' ' ' GLU . 1.0 OUTLIER -72.11 -31.18 65.79 Favored 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 121.997 -0.439 . . . . 0.0 111.13 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 71.6 mm-40 -56.55 138.37 76.26 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-O 120.891 0.377 . . . . 0.0 110.503 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 23.3 Cg_exo -68.81 -28.84 29.62 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.33 2.686 . . . . 0.0 115.797 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 39.8 p -140.8 170.23 16.14 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 118.643 0.656 . . . . 0.0 110.573 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.52 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 15.4 tt0 -53.86 -21.18 7.08 Favored 'General case' 0 C--N 1.338 0.068 0 O-C-N 123.631 0.582 . . . . 0.0 110.03 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.486 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.7 OUTLIER -40.46 -80.67 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 O-C-N 124.219 0.95 . . . . 0.0 110.612 178.643 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.672 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 25.8 mt-30 -92.44 -6.9 49.01 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.501 179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.983 ' HG2' HG21 ' A' ' 22' ' ' THR . 42.3 ttm180 -69.37 -58.06 4.49 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.06 -44.83 79.13 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -55.66 -34.28 64.84 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.368 0.418 . . . . 0.0 111.246 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.773 ' HG3' HG22 ' A' ' 43' ' ' VAL . 15.7 tpt -67.36 -43.93 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.641 HD12 ' HE1' ' A' ' 59' ' ' MET . 14.9 tp -61.16 -52.96 62.66 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.308 0.575 . . . . 0.0 109.735 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.684 HG13 ' O ' ' A' ' 53' ' ' ALA . 5.8 mt -61.46 -30.62 48.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.463 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -73.57 -38.28 65.23 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.46 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.842 ' HE1' HD21 ' A' ' 35' ' ' LEU . 16.8 mtm -57.32 -54.24 49.0 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.385 0.612 . . . . 0.0 109.393 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.801 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.1 mp -59.43 -40.78 82.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.554 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.413 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 8.1 tt -48.72 -47.27 41.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.074 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -111.0 40.55 2.01 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.045 0.45 . . . . 0.0 111.768 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 59' ' ' MET . 18.3 tttp -126.58 -164.98 1.39 Allowed 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -101.93 165.48 11.16 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 120.972 0.415 . . . . 0.0 111.73 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.5 p30 -65.04 -18.17 65.07 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.924 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -63.14 -46.2 88.35 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -27.16 63.27 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.303 0.573 . . . . 0.0 109.564 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.903 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.3 t80 -68.24 -40.67 81.95 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.805 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.698 HG11 ' HB ' ' A' ' 93' ' ' VAL . 20.0 t -70.22 -28.71 36.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.3 t -70.0 -50.73 38.65 Favored 'General case' 0 C--O 1.231 0.08 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.408 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 18.1 t80 -57.95 -37.61 74.46 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.659 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 45.6 t80 -60.43 -50.89 71.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.74 0.781 . . . . 0.0 109.533 177.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -59.57 -35.67 74.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.841 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.06 79.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.897 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.794 HD23 HD13 ' A' ' 25' ' ' ILE . 28.9 mt -65.96 -34.9 79.17 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.927 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 9.6 mp -78.2 -17.0 57.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.4 178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -75.25 -33.06 61.27 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.547 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 78' ' ' GLU . 62.4 mm-40 -105.94 -139.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.242 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -114.36 42.97 1.79 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.584 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.542 ' CD2' HD11 ' A' ' 25' ' ' ILE . 94.6 m-85 -129.56 42.31 3.31 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.915 0.864 . . . . 0.0 110.44 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.927 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 78.8 mttt -74.2 -12.15 60.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.635 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -81.32 -44.82 17.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.398 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.577 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -62.22 -45.26 94.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.659 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.81 -30.64 71.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.149 178.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.72 -36.85 83.45 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 83' ' ' LEU . 59.0 mt -61.82 -28.31 69.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.007 176.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.749 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 1.3 mt -95.91 -14.1 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.814 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -57.2 -22.16 38.75 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.145 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.38 -30.67 67.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.316 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -98.8 -19.14 23.09 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.892 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 87' ' ' LEU . 38.8 mm -68.93 113.85 19.05 Favored Pre-proline 0 C--O 1.232 0.145 0 CA-C-N 117.035 0.418 . . . . 0.0 111.179 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 2.7 Cg_exo -76.5 -40.85 0.51 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.796 2.331 . . . . 0.0 111.991 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.698 ' HB ' HG11 ' A' ' 69' ' ' VAL . 42.0 t -81.67 84.75 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.285 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.6 m -98.6 37.49 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.477 0.656 . . . . 0.0 110.008 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 45.9 m -146.06 82.93 1.62 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.292 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.6 m -80.0 138.2 36.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.399 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.132 -0.937 . . . . 0.0 109.499 -179.767 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.063 -0.415 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -62.32 -33.92 79.01 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.999 2.466 . . . . 0.0 112.43 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' A' ' -3' ' ' LEU . 3.1 pp -81.79 7.67 12.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.535 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -85.94 64.46 4.07 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.235 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 2.6 p -152.18 -172.85 4.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.531 0.205 . . . . 0.0 110.794 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.456 ' H ' ' CE ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -71.72 -177.24 1.86 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 110.818 -179.825 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -64.9 135.09 55.32 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.831 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -64.76 -30.49 71.51 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.767 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -69.22 -36.81 77.64 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 1.012 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.34 -50.69 13.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.828 178.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttp85 -58.22 -30.04 66.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.283 0.563 . . . . 0.0 111.425 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.573 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 10.5 m-20 -81.11 -53.96 5.95 Favored 'General case' 0 C--O 1.204 -1.294 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.401 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.699 ' SG ' ' HA ' ' A' ' 87' ' ' LEU . 26.7 p -49.48 -24.96 2.29 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.032 0.833 . . . . 0.0 110.738 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.721 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 5.6 tp -73.41 -62.63 1.41 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.09 178.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HG ' ' A' ' 16' ' ' LEU . 16.6 mt -83.7 -18.51 37.72 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.573 ' HB3' ' O ' ' A' ' 7' ' ' ASN . 0.7 OUTLIER -68.36 -33.28 74.0 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 122.844 0.458 . . . . 0.0 110.33 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -84.64 41.1 0.83 Allowed 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 121.689 0.757 . . . . 0.0 109.439 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 8.1 tpp180 -45.76 -35.12 4.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.76 -1.564 . . . . 0.0 112.369 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.03 -25.56 63.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.133 0.492 . . . . 0.0 109.823 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.92 -27.71 8.68 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.928 178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.609 ' CD2' HD12 ' A' ' 20' ' ' ILE . 1.8 tm? -52.05 -86.78 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.531 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -61.72 -4.76 1.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.102 0.778 . . . . 0.0 113.102 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 12.5 tmtt? -83.92 -44.92 13.74 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.087 -0.383 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -113.95 -20.11 11.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.609 HD12 ' CD2' ' A' ' 16' ' ' LEU . 4.7 tt -59.49 128.09 19.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 121.588 0.708 . . . . 0.0 111.566 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -149.03 174.22 12.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.992 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.679 HG23 ' H ' ' A' ' 23' ' ' SER . 2.9 t -108.95 -102.8 0.37 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.722 0.268 . . . . 0.0 111.722 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.679 ' H ' HG23 ' A' ' 22' ' ' THR . 49.7 m 40.13 -106.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -62.97 -45.76 90.93 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.801 0.84 . . . . 0.0 112.278 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.648 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -53.51 -52.91 28.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.377 0.608 . . . . 0.0 111.223 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.669 ' O ' HG13 ' A' ' 30' ' ' ILE . 43.1 ttp -72.41 -17.59 61.79 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.978 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.09 -39.49 75.53 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.498 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.3 m-70 -68.56 -32.49 72.45 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.34 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.483 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 48.8 mtp -68.34 -39.6 81.83 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.864 0.364 . . . . 0.0 111.628 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.693 HD13 ' HB2' ' A' ' 40' ' ' GLU . 15.8 mt -78.98 -39.9 22.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.84 0.352 . . . . 0.0 110.072 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.2 m -65.56 -25.47 67.44 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.053 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.561 ' HB3' ' HD1' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -82.04 -22.74 36.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.562 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.65 6.91 58.15 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.275 -0.964 . . . . 0.0 113.614 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.561 ' HD1' ' HB3' ' A' ' 32' ' ' ASP . 26.2 m-85 -79.62 -37.06 36.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 117.55 0.675 . . . . 0.0 109.397 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.483 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 45.6 mt -100.07 132.7 45.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.77 -179.88 5.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.235 0.54 . . . . 0.0 112.135 -177.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.534 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -60.03 -38.39 76.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.071 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 t -66.08 -40.54 90.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.229 0.538 . . . . 0.0 109.889 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -64.12 -47.1 81.31 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.762 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.693 ' HB2' HD13 ' A' ' 30' ' ' ILE . 37.6 tt0 -61.43 -46.31 90.66 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.581 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -48.22 -62.37 1.52 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -57.2 -48.39 78.89 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.552 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 60.3 t -60.07 -45.71 95.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.041 0.448 . . . . 0.0 110.152 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -69.65 -31.05 68.9 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.235 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -61.86 -41.74 98.2 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 120.662 0.268 . . . . 0.0 111.646 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 58.4 mm-40 -68.55 154.08 94.93 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.015 0.436 . . . . 0.0 111.424 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 8.4 Cg_exo -75.32 -65.98 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.229 2.62 . . . . 0.0 116.905 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 39.9 p -124.36 -171.39 2.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -175.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.439 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 36.3 tp60 -40.07 -32.65 0.18 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.647 1.179 . . . . 0.0 112.03 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.686 HE21 ' HG2' ' A' ' 51' ' ' GLN . 32.4 tt0 -48.0 -92.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.76 -1.109 . . . . 0.0 112.008 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.686 ' HG2' HE21 ' A' ' 50' ' ' GLN . 15.8 mm100 -85.61 -7.94 58.54 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.729 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 28.2 ttp180 -84.6 -53.54 5.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.598 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.738 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -71.19 -41.44 70.3 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 120.142 -0.623 . . . . 0.0 109.869 178.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.2 -28.95 68.39 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.938 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.627 ' O ' ' HG3' ' A' ' 59' ' ' MET . 51.3 tpp -69.31 -38.91 78.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD12 ' CE ' ' A' ' 59' ' ' MET . 17.3 tp -63.21 -55.04 28.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.1 mt -61.2 -27.16 41.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.905 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.445 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 24.9 ttmm -76.58 -35.98 57.83 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.104 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.627 ' HG3' ' O ' ' A' ' 55' ' ' MET . 20.0 mtm -59.95 -48.86 79.98 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.567 0.699 . . . . 0.0 109.351 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.35 -47.87 90.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.827 -1.078 . . . . 0.0 111.913 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.445 ' HG ' ' HA ' ' A' ' 58' ' ' LYS . 4.6 pp -62.76 -13.49 33.63 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.932 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.98 36.27 4.67 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.159 0.504 . . . . 0.0 110.621 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG2' ' OG ' ' A' ' 67' ' ' SER . 21.3 tptt -130.15 -118.41 0.23 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.507 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 3.4 t0 -158.19 178.34 10.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.62 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 10.1 p30 -66.47 -15.99 63.77 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.83 -52.61 62.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.521 ' OG ' ' HG2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -78.29 -29.09 47.67 Favored 'General case' 0 CA--C 1.509 -0.615 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.226 178.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 1.012 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 9.8 t80 -68.39 -44.54 74.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.635 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 91' ' ' ILE . 60.3 t -68.65 -27.48 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.495 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.7 t -70.14 -50.35 41.41 Favored 'General case' 0 C--O 1.228 -0.038 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -57.18 -37.38 72.05 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.0 -51.06 71.71 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.699 176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.99 -37.38 76.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.32 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.23 -34.25 77.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 111.027 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.648 HD23 HD13 ' A' ' 25' ' ' ILE . 84.7 mt -64.68 -36.56 84.65 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -70.73 -13.82 62.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.342 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -83.68 -43.0 16.02 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.485 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.0 mm-40 -102.56 39.17 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 60.73 33.06 81.15 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 116.164 1.226 . . . . 0.0 116.164 176.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD11 ' A' ' 25' ' ' ILE . 6.2 m-30 -114.99 41.78 2.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 118.134 0.967 . . . . 0.0 108.813 178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -71.9 -13.24 61.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.006 -178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -72.86 -51.08 20.16 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -61.2 -47.55 85.61 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.687 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.74 -35.75 77.16 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.639 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.72 -36.71 84.38 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 73.1 mt -62.97 -23.08 67.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.02 177.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.721 ' CD2' ' HA ' ' A' ' 9' ' ' LEU . 5.1 mt -97.53 -16.54 20.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.969 -177.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -62.35 -18.03 60.43 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.428 0.633 . . . . 0.0 110.007 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.94 -29.04 70.25 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.534 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.468 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -102.34 -20.01 13.09 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.59 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.606 HG23 HG22 ' A' ' 69' ' ' VAL . 39.3 mm -71.99 119.71 76.05 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.748 0.274 . . . . 0.0 110.446 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 10.9 Cg_exo -72.59 -8.24 22.18 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.352 2.701 . . . . 0.0 112.983 -179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.579 ' H ' HG22 ' A' ' 91' ' ' ILE . 39.5 t -83.52 110.15 17.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.128 0.49 . . . . 0.0 110.249 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.3 m -125.66 40.71 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.286 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.8 t -161.05 82.16 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.235 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.2 p -82.23 -171.25 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.424 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.8 m . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.65 -0.691 . . . . 0.0 110.31 179.246 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -70.36 126.17 12.62 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.801 2.334 . . . . 0.0 111.863 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' -3' ' ' LEU . 1.1 tm? -145.93 109.09 4.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.078 0.466 . . . . 0.0 109.988 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 161.35 -171.47 37.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.824 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.52 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 14.5 m -82.37 176.01 9.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.585 0.231 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.504 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -80.52 -172.19 3.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.342 0.591 . . . . 0.0 111.035 179.5 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.496 ' OD2' ' HB3' ' A' ' 4' ' ' LYS . 37.6 t70 -71.52 132.04 44.14 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.442 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -61.33 -44.26 97.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.178 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -59.03 -39.23 81.34 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.817 0.341 . . . . 0.0 110.254 179.428 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.869 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -72.72 -57.66 3.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.109 178.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.449 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 7.2 tmm_? -56.84 -31.0 64.32 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.741 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 14.8 m-20 -76.13 -49.91 16.06 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.24 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.52 ' SG ' ' HE2' ' A' ' 4' ' ' LYS . 54.3 m -54.35 -20.68 7.74 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.328 0.585 . . . . 0.0 110.134 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.815 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.9 tp -78.15 -63.03 1.49 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.574 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.656 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.9 mt -79.18 -25.58 42.75 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -68.22 -32.95 73.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -86.12 40.31 0.86 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.628 0.727 . . . . 0.0 109.822 177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.747 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 9.5 tpt180 -50.3 -30.46 12.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.756 -1.565 . . . . 0.0 111.392 178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -62.57 -26.89 68.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.379 0.609 . . . . 0.0 109.738 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -105.85 -31.47 8.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.846 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.954 ' HG ' HD12 ' A' ' 20' ' ' ILE . 6.2 tt -52.03 -74.04 0.04 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 123.604 0.761 . . . . 0.0 110.813 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 16' ' ' LEU . 3.4 tp10 -55.69 -16.74 4.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -85.12 -43.0 14.25 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -105.92 -30.75 9.15 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.954 HD12 ' HG ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -59.73 133.36 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.259 0.552 . . . . 0.0 110.882 -179.661 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' H ' HD12 ' A' ' 25' ' ' ILE . 14.9 ttmm -137.33 164.09 29.42 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.733 ' HA ' HD22 ' A' ' 56' ' ' LEU . 8.6 t -120.33 -0.12 10.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.9 m -86.95 -82.87 0.2 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.25 -0.906 . . . . 0.0 112.849 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.14 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 122.5 0.32 . . . . 0.0 111.769 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD23 ' A' ' 75' ' ' LEU . 50.9 mt -55.39 -45.97 78.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.459 0.647 . . . . 0.0 110.861 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.724 ' O ' HG13 ' A' ' 30' ' ' ILE . 65.3 ttp -74.22 -20.05 60.31 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.634 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -70.99 -35.18 72.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.26 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.572 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.6 m-70 -77.2 -25.52 51.85 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.762 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 37.5 mtp -76.1 -38.32 57.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.77 0.319 . . . . 0.0 111.831 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 26' ' ' MET . 26.0 mt -74.46 -43.79 48.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -65.21 -26.1 67.99 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.431 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 34.2 t0 -69.41 -29.41 67.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.7 -2.2 52.74 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.14 -1.028 . . . . 0.0 113.285 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.437 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 3.9 m-85 -78.98 -41.1 29.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.185 0.517 . . . . 0.0 109.739 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.928 HD21 ' HE1' ' A' ' 59' ' ' MET . 2.5 mp -89.29 119.37 29.71 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.9 m -83.77 165.62 18.69 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.583 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -52.9 -40.68 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 O-C-N 123.163 0.289 . . . . 0.0 110.514 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 62.0 m -68.07 -30.91 70.22 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.658 0.266 . . . . 0.0 110.628 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.66 -47.3 63.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.485 ' HB2' HD13 ' A' ' 30' ' ' ILE . 25.4 tt0 -59.38 -52.91 63.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.179 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.4 tp10 -35.82 -65.41 0.25 Allowed 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 114.422 -1.263 . . . . 0.0 113.863 -178.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 42' ' ' LYS . 23.7 ttmt -62.5 -47.74 82.63 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -177.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.614 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.1 t -60.05 -35.94 64.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.494 0.664 . . . . 0.0 110.648 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -85.99 -27.95 24.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.748 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -67.44 -40.79 85.47 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.727 ' HG3' ' HB3' ' A' ' 51' ' ' GLN . 4.4 mm-40 -61.98 152.46 77.05 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 17.9 Cg_endo -98.43 -10.65 0.45 Allowed 'Trans proline' 0 CA--C 1.537 0.649 0 N-CA-C 118.164 2.332 . . . . 0.0 118.164 -174.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.6 p -125.33 165.58 18.11 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 120.43 1.468 . . . . 0.0 111.282 -178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -57.43 -18.16 16.74 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.503 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -52.55 -85.97 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.154 177.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.727 ' HB3' ' HG3' ' A' ' 46' ' ' GLU . 98.9 mm-40 -78.21 -6.88 56.22 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.988 -179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.488 ' HB3' HG21 ' A' ' 22' ' ' THR . 89.5 mtt180 -81.52 -70.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.942 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -62.54 -47.26 84.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.243 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -60.92 -28.21 68.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.18 -0.608 . . . . 0.0 112.132 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.666 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -74.1 -36.1 64.22 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 118.855 0.752 . . . . 0.0 109.599 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.733 HD22 ' HA ' ' A' ' 22' ' ' THR . 15.9 tp -63.12 -53.36 54.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.751 0.786 . . . . 0.0 109.171 177.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.746 HG12 ' O ' ' A' ' 53' ' ' ALA . 4.3 mm -65.24 -26.09 38.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.505 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 38.3 ttmt -74.92 -32.09 61.7 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.661 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.928 ' HE1' HD21 ' A' ' 35' ' ' LEU . 14.0 mtm -62.6 -47.58 83.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 177.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 11.0 mt -63.47 -26.72 41.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.357 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.895 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 61' ' ' LEU . 6.1 tt -61.43 -31.24 71.17 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.371 -0.604 . . . . 0.0 109.371 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.5 mttm -137.52 40.51 2.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.52 ' O ' ' HA ' ' A' ' -1' ' ' SER . 22.0 tptp -100.78 -112.48 0.19 Allowed 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 121.645 -0.66 . . . . 0.0 109.399 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HE3' ' A' ' 1' ' ' MET . 2.1 p30 -160.83 157.96 27.6 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.775 ' O ' HG23 ' A' ' 69' ' ' VAL . 23.1 p30 -62.94 -23.82 67.58 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -63.63 -49.02 74.93 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -71.72 -25.28 62.01 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.869 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 5.7 t80 -71.26 -40.93 70.66 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.429 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 65' ' ' ASN . 6.0 t -72.91 -23.0 20.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 177.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 35.7 t -73.72 -47.42 39.46 Favored 'General case' 0 C--N 1.342 0.27 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -58.35 -39.59 79.9 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.495 ' CE2' ' HB1' ' A' ' 84' ' ' ALA . 53.2 t80 -57.82 -46.18 85.08 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.701 177.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 70' ' ' SER . 22.1 t-20 -59.45 -40.2 86.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.093 -1.412 . . . . 0.0 110.867 178.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -36.12 83.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.807 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 25' ' ' ILE . 93.9 mt -62.93 -35.64 80.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -72.67 -14.12 61.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.077 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -86.19 -39.69 16.37 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.088 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -102.69 37.9 1.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.26 42.26 97.2 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 115.463 0.945 . . . . 0.0 115.463 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -125.55 45.73 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.853 0.826 . . . . 0.0 109.889 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.3 -31.98 72.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.441 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -68.0 -42.06 81.3 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.592 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -64.04 -45.59 88.16 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.729 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.495 ' HB1' ' CE2' ' A' ' 72' ' ' TYR . . . -59.44 -38.31 80.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.583 178.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.99 80.34 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.41 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 35.5 mt -63.82 -25.49 68.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.404 0.621 . . . . 0.0 110.31 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.815 HD11 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mp -95.21 -16.02 22.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.395 -178.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -62.72 -15.2 51.84 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.291 0.567 . . . . 0.0 109.722 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -61.23 -22.52 64.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.436 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.529 ' HA3' ' CA ' ' A' ' 5' ' ' ALA . . . -112.8 -15.71 9.13 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.197 -0.911 . . . . 0.0 112.541 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 87' ' ' LEU . 27.2 mm -83.94 113.31 46.88 Favored Pre-proline 0 C--O 1.232 0.151 0 CA-C-N 117.142 0.471 . . . . 0.0 110.517 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -60.68 -67.21 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.357 0 C-N-CA 122.84 2.36 . . . . 0.0 112.499 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.5 m -130.14 152.82 38.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.094 0.473 . . . . 0.0 110.877 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.8 t -106.9 66.33 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.187 0.518 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.2 m 62.83 -177.6 0.14 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.794 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.9 m -129.89 39.87 3.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 109.892 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.686 -0.673 . . . . 0.0 111.022 -179.538 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.58 -172.29 1.42 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.919 2.413 . . . . 0.0 112.259 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.557 HD22 ' HB3' ' A' ' 64' ' ' ASP . 1.6 tt -141.84 126.08 17.51 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -145.48 13.32 1.8 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 119.872 -1.156 . . . . 0.0 114.308 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.2 p -155.07 166.42 33.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.943 0.871 . . . . 0.0 112.669 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.57 ' HG3' ' HA ' ' A' ' 65' ' ' ASN . 24.5 ttm -104.22 149.38 25.34 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.51 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 65' ' ' ASN . 64.1 t0 -68.33 123.96 22.19 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -60.79 -35.55 76.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.485 -179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -66.91 -32.3 73.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.284 0.564 . . . . 0.0 109.651 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.791 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -76.75 -57.41 3.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.548 177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 52.3 ttp85 -57.44 -29.82 64.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.005 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 23.9 m-20 -80.11 -48.55 13.04 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 119.095 -0.478 . . . . 0.0 111.241 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -56.36 -18.76 11.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.691 0.678 . . . . 0.0 110.014 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.03 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.1 tp -80.18 -65.5 1.0 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.301 177.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.786 ' HA ' HD13 ' A' ' 16' ' ' LEU . 85.4 mt -68.24 -31.21 70.55 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -62.11 -31.99 72.5 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.308 0.643 . . . . 0.0 110.639 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -79.0 43.78 0.53 Allowed 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 122.426 1.108 . . . . 0.0 109.525 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.527 ' H ' ' C ' ' A' ' 11' ' ' GLN . 8.8 tpt180 -54.86 -18.32 4.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 112.45 -2.159 . . . . 0.0 110.161 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 14' ' ' GLU . 4.1 mp0 -61.26 -28.87 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB3' ' A' ' 18' ' ' LYS . . . -132.93 -2.67 3.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.026 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.786 HD13 ' HA ' ' A' ' 10' ' ' LEU . 9.0 tp -49.98 -79.35 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -67.39 -19.08 65.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.417 0.627 . . . . 0.0 111.131 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.558 ' HB3' ' HA ' ' A' ' 15' ' ' ALA . 88.2 tttt -76.38 -21.02 56.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.183 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -129.39 -36.13 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG21 HG12 ' A' ' 57' ' ' ILE . 8.1 mt -54.78 104.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-O 121.83 0.824 . . . . 0.0 110.803 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -108.0 158.48 17.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.423 -179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.596 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -101.97 -102.79 0.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 118.932 -0.556 . . . . 0.0 109.694 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.563 ' H ' HG23 ' A' ' 22' ' ' THR . 19.3 t 26.41 -100.55 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.474 1.11 . . . . 0.0 113.971 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -54.7 -54.24 44.46 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.84 HD13 HD23 ' A' ' 75' ' ' LEU . 95.0 mt -55.47 -44.61 76.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.382 0.61 . . . . 0.0 110.903 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.777 ' O ' HG12 ' A' ' 30' ' ' ILE . 11.8 ttt -68.57 -27.47 66.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.034 178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.32 -35.31 79.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.509 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 80.5 m-70 -76.88 -29.69 55.9 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.817 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.514 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 34.7 mtp -73.2 -36.99 66.61 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.391 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 35' ' ' LEU . 11.6 mm -72.87 -42.41 60.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -27.43 66.91 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.048 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 23.0 t0 -73.52 -23.55 60.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.5 5.45 69.35 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.618 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 7.5 m-85 -79.61 -29.7 41.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.26 0.552 . . . . 0.0 109.981 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.887 ' HB2' HD13 ' A' ' 30' ' ' ILE . 54.8 mt -105.65 118.48 36.69 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 176.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.4 p -82.81 -176.2 6.18 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.552 -178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.84 -32.66 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 p -71.21 -35.7 71.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.527 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.6 mm-40 -69.79 -49.31 54.11 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.639 ' HB2' HD12 ' A' ' 30' ' ' ILE . 34.3 tt0 -59.41 -38.45 80.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.285 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -56.25 -59.85 4.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.067 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 52.5 mttm -62.46 -50.37 71.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.638 HG22 ' HG3' ' A' ' 55' ' ' MET . 49.1 t -53.32 -46.05 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 111.31 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.01 -31.12 56.17 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -71.24 -17.85 62.47 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.1 mm-40 -60.68 153.47 62.48 Favored Pre-proline 0 CA--C 1.541 0.604 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -60.17 -56.69 1.0 Allowed 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.935 2.424 . . . . 0.0 114.994 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.495 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 37.5 p -136.07 -176.14 4.22 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.845 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 38.6 tt0 -57.06 -21.32 30.55 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.893 HE21 ' HG3' ' A' ' 51' ' ' GLN . 14.4 tt0 -44.98 -69.54 0.13 Allowed 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 124.061 0.85 . . . . 0.0 109.634 177.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.893 ' HG3' HE21 ' A' ' 50' ' ' GLN . 87.7 mt-30 -91.32 -9.52 44.69 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.533 178.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.845 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 2.8 tpp180 -71.45 -57.42 4.45 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.742 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.86 -42.13 86.16 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.46 -34.26 72.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.011 178.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.649 ' O ' ' HG3' ' A' ' 59' ' ' MET . 12.5 tpt -68.29 -40.77 81.68 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 22' ' ' THR . 12.4 tp -59.4 -52.05 67.3 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.791 HG12 HG21 ' A' ' 20' ' ' ILE . 7.3 mt -63.07 -33.7 62.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.461 178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -69.73 -33.5 72.57 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.627 -0.261 . . . . 0.0 111.266 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.649 ' HG3' ' O ' ' A' ' 55' ' ' MET . 22.0 mtm -62.26 -49.1 77.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.438 HG23 ' HE1' ' A' ' 1' ' ' MET . 15.0 mt -64.04 -29.93 48.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.39 -179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.47 -22.14 64.8 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.03 0.443 . . . . 0.0 110.03 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.89 41.6 2.31 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.119 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.6 tttp -118.93 -145.1 0.37 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.059 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.557 ' HB3' HD22 ' A' ' -3' ' ' LEU . 1.1 m-20 -114.72 155.73 26.12 Favored 'General case' 0 CA--C 1.514 -0.421 0 O-C-N 122.316 -0.24 . . . . 0.0 110.972 -178.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.69 ' O ' HG23 ' A' ' 69' ' ' VAL . 19.9 p30 -61.3 -30.63 70.61 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.65 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -64.4 -42.65 95.97 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.626 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -69.81 -29.38 66.65 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.791 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 12.2 t80 -68.52 -41.1 80.4 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.004 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.692 HG11 ' HA ' ' A' ' 94' ' ' VAL . 19.1 t -67.82 -28.14 40.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -70.5 -50.65 35.65 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.418 ' HE2' HD13 ' A' ' 9' ' ' LEU . 12.0 t80 -56.03 -40.78 73.95 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.692 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 24.0 t80 -58.51 -50.17 74.74 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.454 177.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -63.72 -30.37 71.48 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.459 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -69.47 -35.8 75.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 109.929 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.84 HD23 HD13 ' A' ' 25' ' ' ILE . 19.5 mt -65.63 -28.14 68.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 177.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.858 ' HA ' ' HG2' ' A' ' 81' ' ' LYS . 8.7 mp -83.4 -13.21 55.35 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.031 178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -79.14 -31.37 44.04 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -106.4 -151.01 0.45 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.002 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -104.92 43.25 1.7 Allowed Glycine 0 CA--C 1.523 0.535 0 C-N-CA 120.081 -1.057 . . . . 0.0 114.509 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CD1' HD11 ' A' ' 25' ' ' ILE . 31.4 m-85 -125.9 38.93 4.06 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.992 0.901 . . . . 0.0 109.492 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.858 ' HG2' ' HA ' ' A' ' 76' ' ' LEU . 89.8 mttt -71.86 -16.96 62.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.373 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -78.01 -44.43 26.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.57 0.224 . . . . 0.0 110.748 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -62.93 -47.32 83.76 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.411 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.4 -35.07 76.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.203 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.94 -34.12 77.65 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 83' ' ' LEU . 28.1 mt -63.83 -26.78 68.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.723 177.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 1.03 HD22 ' HA ' ' A' ' 9' ' ' LEU . 0.9 OUTLIER -96.18 -13.9 23.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 -178.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.549 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 11.1 t-160 -59.79 -19.67 52.06 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -58.12 -33.69 69.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.093 -1.412 . . . . 0.0 109.87 178.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.561 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -100.02 -18.91 20.93 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.231 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.549 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 49.4 mm -75.79 113.83 30.85 Favored Pre-proline 0 CA--C 1.528 0.101 0 CA-C-N 116.653 0.226 . . . . 0.0 110.653 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 6.1 Cg_exo -73.43 -68.76 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.57 2.18 . . . . 0.0 111.96 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.8 m -135.5 149.02 28.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.477 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.692 ' HA ' HG11 ' A' ' 69' ' ' VAL . 20.2 t -89.28 75.0 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.645 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 17.7 m 52.05 43.91 30.01 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.895 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.2 t -150.23 134.15 16.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.107 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.629 -0.7 . . . . 0.0 110.423 -179.97 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.846 0 N-CA-C 112.207 -0.357 . . . . 0.0 112.207 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -86.38 -0.5 8.27 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 122.898 2.399 . . . . 0.0 113.276 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 41.3 tp -109.0 144.88 36.41 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 122.148 -0.345 . . . . 0.0 111.067 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -129.08 -45.89 0.18 Allowed Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.3 p -157.79 -140.84 0.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.674 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.7 OUTLIER -74.45 179.63 4.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.75 131.85 40.08 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.063 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.56 -44.82 95.38 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.85 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -58.61 -30.77 67.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.104 0.478 . . . . 0.0 110.104 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.788 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -79.3 -57.18 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.516 0.674 . . . . 0.0 109.861 178.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.674 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 46.9 ttp180 -59.06 -30.7 68.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.802 -179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -73.36 -48.69 32.12 Favored 'General case' 0 C--O 1.203 -1.355 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.472 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 17.4 m -55.02 -23.16 18.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.27 0.557 . . . . 0.0 110.127 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.965 ' HA ' HD11 ' A' ' 87' ' ' LEU . 11.2 tp -76.83 -60.67 2.26 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.308 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.737 ' HA ' HD22 ' A' ' 16' ' ' LEU . 0.8 OUTLIER -85.34 -24.71 27.5 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.096 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' A' ' 13' ' ' ARG . 3.4 tt0 -64.59 -35.88 82.43 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -86.56 42.11 0.99 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 6.3 tmm_? -47.73 -34.74 8.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 113.84 -1.527 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -53.37 -30.85 41.83 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.936 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -107.71 -28.21 9.84 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.885 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 13' ' ' ARG . 38.9 tp -47.11 -85.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.593 0.757 . . . . 0.0 112.441 179.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' HG22 ' A' ' 20' ' ' ILE . 30.3 tt0 -62.74 -8.72 7.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.94 -42.65 13.86 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.885 -0.509 . . . . 0.0 111.327 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -102.42 -31.14 10.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.689 -178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.567 HD12 HD12 ' A' ' 16' ' ' LEU . 2.6 tt -61.34 140.06 19.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.949 0.404 . . . . 0.0 110.393 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -136.19 179.05 6.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.764 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -120.06 -94.01 0.51 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.711 ' H ' HG23 ' A' ' 22' ' ' THR . 51.7 p -7.55 -70.81 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.26 1.948 . . . . 0.0 116.26 -178.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -65.55 -55.31 18.44 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.614 HD11 ' CD2' ' A' ' 80' ' ' TYR . 81.2 mt -56.94 -41.1 76.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-O 122.065 0.936 . . . . 0.0 110.273 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.727 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.3 ttt -70.37 -24.7 63.01 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.478 -1.237 . . . . 0.0 111.06 179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.88 -41.23 71.63 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.511 -0.875 . . . . 0.0 109.293 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.544 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 83.9 m-70 -67.2 -32.74 74.01 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.882 178.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.769 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 35.0 mtp -74.65 -37.22 62.8 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.727 HD11 ' HE2' ' A' ' 26' ' ' MET . 16.9 mt -76.76 -41.13 33.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.1 m -66.37 -25.51 66.83 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 22.2 t0 -72.9 -24.96 60.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 -0.54 61.1 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.208 178.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.834 ' HD2' ' HA ' ' A' ' 67' ' ' SER . 2.4 m-85 -79.87 -39.49 30.43 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.769 ' HG ' ' HB3' ' A' ' 29' ' ' MET . 29.7 mt -93.51 117.68 30.38 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 176.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.1 p -89.14 -171.83 3.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.812 -177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 58.5 mt -65.02 -23.2 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.0 t -70.35 -47.7 59.8 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.513 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' HD22 ' A' ' 35' ' ' LEU . 9.2 mp0 -65.18 -42.57 93.53 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.528 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 39.5 tt0 -59.36 -51.75 68.59 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.487 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.532 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 34.3 tt0 -53.72 -48.08 69.94 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.795 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 97.9 mttt -59.63 -60.07 4.44 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.464 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 87.3 t -57.95 -35.69 53.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.476 . . . . 0.0 111.357 -178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -28.2 39.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.687 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.532 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -68.18 -33.92 75.34 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 122.052 -0.405 . . . . 0.0 110.667 -179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 5.2 mm-40 -58.48 147.23 69.9 Favored Pre-proline 0 CA--C 1.536 0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.04 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -59.12 -72.55 0.03 OUTLIER 'Trans proline' 0 N--CA 1.478 0.575 0 C-N-CA 123.181 2.587 . . . . 0.0 116.123 -176.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.5 p -122.16 -176.19 3.3 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.558 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 19.0 tt0 -48.56 -26.62 2.29 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 123.864 0.727 . . . . 0.0 110.72 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.614 HE21 ' HG3' ' A' ' 51' ' ' GLN . 19.0 tt0 -45.56 -76.16 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.546 178.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' HE21 ' A' ' 50' ' ' GLN . 68.0 mt-30 -84.41 -14.62 48.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.204 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 31.1 ttm180 -72.74 -56.96 4.49 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.675 0.274 . . . . 0.0 110.802 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.676 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -67.43 -40.52 85.5 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.38 -32.7 72.63 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.206 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.65 ' O ' ' HG3' ' A' ' 59' ' ' MET . 10.2 tpt -69.22 -36.16 76.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.0 tp -63.01 -52.18 63.91 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ALA . 4.1 mt -60.94 -34.12 58.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.296 177.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.707 ' HA ' HD12 ' A' ' 61' ' ' LEU . 86.8 tttt -66.33 -37.2 84.81 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.696 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.65 ' HG3' ' O ' ' A' ' 55' ' ' MET . 7.4 mtm -62.21 -45.31 93.92 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 57' ' ' ILE . 18.1 mt -64.23 -24.67 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.768 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.707 HD12 ' HA ' ' A' ' 58' ' ' LYS . 14.5 mt -59.44 -25.73 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.352 178.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -140.69 39.06 1.84 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HD2' ' HA ' ' A' ' 63' ' ' LYS . 31.8 tptt -99.94 -114.05 0.17 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.529 -0.732 . . . . 0.0 109.806 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HE3' ' A' ' 1' ' ' MET . 13.2 m-20 -160.37 169.31 23.36 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.11 0.481 . . . . 0.0 111.616 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 13.7 t-20 -56.81 -45.3 82.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.678 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -57.0 -48.67 77.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.049 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.834 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -69.92 -30.07 67.4 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 121.216 0.531 . . . . 0.0 110.406 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.788 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 25.6 t80 -67.75 -42.22 82.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.378 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.4 t -68.75 -29.83 44.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.5 t -69.59 -48.75 59.11 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.426 ' HZ ' HD11 ' A' ' 20' ' ' ILE . 10.4 t80 -57.07 -39.24 74.55 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.487 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 50.7 t80 -58.05 -48.13 81.03 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.681 0.753 . . . . 0.0 109.247 177.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -56.86 -43.81 81.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.334 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.49 ' HB1' HG23 ' A' ' 25' ' ' ILE . . . -63.3 -34.12 77.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.976 179.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.02 -36.93 85.2 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 mp -75.12 -11.86 60.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.71 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -31.52 21.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.848 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -108.74 38.22 2.32 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.21 28.84 55.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 115.724 1.05 . . . . 0.0 115.724 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.614 ' CD2' HD11 ' A' ' 25' ' ' ILE . 22.7 m-30 -108.11 59.43 0.61 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.997 0.899 . . . . 0.0 109.603 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -73.96 -30.89 62.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.356 -1.293 . . . . 0.0 112.206 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -67.1 -51.01 59.48 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.612 0.187 . . . . 0.0 111.471 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.635 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -60.31 -47.95 83.85 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.444 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.487 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.65 -34.4 74.23 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.303 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.82 -37.27 85.79 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 88.5 mt -61.98 -23.47 66.43 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.159 177.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.965 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.8 mp -100.76 -15.16 17.75 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.586 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -56.2 -31.49 63.51 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.408 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.33 -24.88 67.58 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.045 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.494 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -95.81 -21.19 24.27 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.998 178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.688 HG22 ' H ' ' A' ' 93' ' ' VAL . 31.9 mm -74.34 121.73 85.9 Favored Pre-proline 0 C--N 1.33 -0.282 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -87.09 23.8 0.79 Allowed 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.912 2.408 . . . . 0.0 112.508 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.688 ' H ' HG22 ' A' ' 91' ' ' ILE . 71.2 t -132.04 101.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.806 0.336 . . . . 0.0 110.364 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 m -84.45 68.56 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.472 0.654 . . . . 0.0 110.508 179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 29.4 t -67.58 117.11 9.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.636 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -98.28 177.3 5.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.462 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.072 -0.966 . . . . 0.0 109.617 179.848 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.59 -0.604 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.03 94.13 0.55 Allowed 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 122.858 2.372 . . . . 0.0 111.923 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 93.8 mt -114.37 127.35 55.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.453 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 66.75 62.9 4.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.444 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.53 ' H ' ' HB3' ' A' ' 64' ' ' ASP . 40.7 m -111.62 41.32 1.93 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.798 0.332 . . . . 0.0 111.673 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.597 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 36.3 ttm -100.76 123.65 45.26 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.923 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -63.71 139.2 58.74 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.803 -179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.46 -46.47 88.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.989 -179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.9 tptp -61.82 -39.02 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.85 -60.27 2.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.181 178.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 50.8 ttp85 -54.93 -32.92 61.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.355 -179.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -76.37 -47.98 21.48 Favored 'General case' 0 C--O 1.206 -1.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.304 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 86' ' ' LEU . 58.1 m -52.45 -23.86 6.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 118.629 0.649 . . . . 0.0 110.593 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.679 ' HA ' HD22 ' A' ' 87' ' ' LEU . 3.5 tp -83.64 -60.5 2.1 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.532 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.561 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 46.5 mt -76.98 -33.29 57.62 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.677 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.4 tt0 -64.51 -27.59 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 109.631 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -83.09 36.7 0.52 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.889 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.99 -9.45 7.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.775 178.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -68.1 -22.5 64.9 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -129.81 -3.82 4.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.602 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.02 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -50.94 -86.88 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -61.84 -26.3 68.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.99 0.424 . . . . 0.0 110.891 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -62.94 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -112.94 -38.96 4.36 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.02 HD12 ' HG ' ' A' ' 16' ' ' LEU . 36.7 mt -55.75 107.79 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-O 121.387 0.613 . . . . 0.0 111.593 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.694 ' HB2' ' HE2' ' A' ' 80' ' ' TYR . 74.6 tttt -97.75 147.04 24.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.694 HG23 ' H ' ' A' ' 23' ' ' SER . 0.8 OUTLIER -97.01 -90.01 0.26 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.006 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.694 ' H ' HG23 ' A' ' 22' ' ' THR . 18.5 m -1.8 -74.49 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -67.19 -53.91 25.98 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.895 HD13 HD23 ' A' ' 75' ' ' LEU . 61.3 mt -57.02 -38.1 58.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.684 0.754 . . . . 0.0 109.958 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.2 ttt -69.67 -28.39 65.84 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.659 178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -66.4 -36.99 84.22 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.717 0.77 . . . . 0.0 109.215 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -70.32 -34.07 72.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.307 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.724 ' HB3' HD13 ' A' ' 35' ' ' LEU . 28.6 mtp -68.09 -36.67 80.17 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.931 0.396 . . . . 0.0 111.593 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 14.4 mt -75.6 -36.55 34.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m -64.87 -27.52 68.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.096 178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.544 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 42.1 m-20 -73.57 -27.5 61.35 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.33 177.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.72 3.14 59.57 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.062 -1.066 . . . . 0.0 112.433 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.544 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 18.2 m-85 -79.45 -21.42 45.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.495 0.664 . . . . 0.0 109.385 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' ' 29' ' ' MET . 9.2 mp -110.52 117.76 34.42 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.6 m -80.32 160.4 25.48 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.419 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 78.2 mt -51.22 -40.81 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 111.177 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.1 p -67.32 -37.77 83.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.806 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 43' ' ' VAL . 14.4 tt0 -66.76 -40.64 88.32 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -62.69 -47.71 82.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.041 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 37' ' ' ILE . 80.9 mt-10 -49.8 -53.98 21.98 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.937 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' ' HD3' ' A' ' 42' ' ' LYS . 32.6 mmtt -63.12 -48.94 76.39 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.76 HG22 ' HG3' ' A' ' 55' ' ' MET . 43.3 t -53.22 -53.58 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 120.954 0.406 . . . . 0.0 109.941 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -66.14 -37.68 86.26 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.2 m-20 -65.51 -25.07 67.3 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.995 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 63.1 mm-40 -62.37 148.5 89.72 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 120.68 0.276 . . . . 0.0 111.424 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 48' ' ' THR . 33.2 Cg_exo -35.6 -84.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 125.249 3.966 . . . . 0.0 116.558 -177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 64.0 p -127.22 -166.46 1.6 Allowed 'General case' 0 CA--C 1.506 -0.735 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.976 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 30.1 tt0 -54.72 -21.2 10.13 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 123.531 0.52 . . . . 0.0 110.039 178.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -47.59 -66.89 0.33 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.608 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.995 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 1.5 tp60 -90.08 -14.02 34.64 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.093 179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.976 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 16.7 tpp85 -70.13 -58.91 3.27 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -66.86 -41.07 87.91 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.1 87.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.859 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.76 ' HG3' HG22 ' A' ' 43' ' ' VAL . 13.7 tpt -67.4 -45.58 75.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 110.532 -0.173 . . . . 0.0 110.532 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.517 HD12 ' HE1' ' A' ' 59' ' ' MET . 27.8 tp -58.89 -52.04 67.45 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.615 0.721 . . . . 0.0 110.49 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.737 HD11 HG21 ' A' ' 20' ' ' ILE . 39.8 mm -67.45 -23.91 30.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.76 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.5 ttmp? -74.38 -36.88 63.54 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.437 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.611 ' HG3' ' O ' ' A' ' 55' ' ' MET . 1.6 mtm -61.86 -51.08 69.67 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 57' ' ' ILE . 34.9 mt -55.66 -34.83 36.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.161 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.14 -27.8 9.44 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.552 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -127.82 37.77 4.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 120.316 -0.554 . . . . 0.0 112.067 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 59' ' ' MET . 65.9 mttm -107.18 -135.89 0.35 Allowed 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.543 -0.723 . . . . 0.0 109.456 177.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.53 ' HB3' ' H ' ' A' ' -1' ' ' SER . 1.3 p30 -142.36 167.84 21.16 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.727 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.5 p30 -63.27 -20.75 65.75 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.947 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -64.47 -48.85 73.7 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -25.47 60.63 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.735 ' OH ' ' HB3' ' A' ' 87' ' ' LEU . 13.0 t80 -68.74 -39.44 80.35 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.876 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.727 HG23 ' O ' ' A' ' 65' ' ' ASN . 35.7 t -70.79 -28.91 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.5 t -66.8 -52.1 47.86 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.635 ' HE2' HD13 ' A' ' 9' ' ' LEU . 24.3 t80 -59.01 -39.41 81.78 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.592 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 31.2 t80 -58.23 -50.81 72.25 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.782 0.801 . . . . 0.0 110.069 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -62.73 -30.29 71.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.014 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.508 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -71.51 -32.4 68.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.928 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.895 HD23 HD13 ' A' ' 25' ' ' ILE . 45.0 mt -65.42 -40.47 93.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 6.6 mp -65.53 -27.9 68.79 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.012 177.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -68.99 -35.17 76.4 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.959 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -109.83 39.0 2.22 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 61.05 16.2 46.92 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.694 ' HE2' ' HB2' ' A' ' 21' ' ' LYS . 17.1 m-30 -101.69 55.79 0.82 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 118.841 1.321 . . . . 0.0 109.244 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.437 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 77.5 mttt -77.59 -13.71 59.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.023 -1.444 . . . . 0.0 111.518 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -79.16 -46.94 16.95 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -62.94 -45.14 93.86 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.758 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.592 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.6 -31.76 72.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.07 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.91 -35.37 80.44 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 83' ' ' LEU . 48.8 mt -61.52 -33.28 73.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.378 177.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.735 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -87.18 -17.66 32.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.734 -178.501 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -57.21 -20.95 30.18 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.322 0.649 . . . . 0.0 110.716 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.04 -20.66 64.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.454 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.543 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -116.26 -11.82 9.49 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.9 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 87' ' ' LEU . 48.0 mm -71.82 120.77 81.98 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.831 0.316 . . . . 0.0 110.311 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.53 1.57 1.65 Allowed 'Trans proline' 0 N--CA 1.481 0.766 0 C-N-CA 123.637 2.891 . . . . 0.0 115.316 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.534 ' H ' HG22 ' A' ' 91' ' ' ILE . 17.1 m -118.09 109.0 25.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.752 0.787 . . . . 0.0 111.932 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.7 81.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.633 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.0 m -84.27 -76.88 0.28 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.284 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.5 m -119.6 -43.38 2.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.071 0.463 . . . . 0.0 110.212 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.5 m . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.821 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.936 -0.465 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.67 -28.57 82.64 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.614 2.209 . . . . 0.0 112.515 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.9 mp -109.27 110.2 21.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 110.38 43.02 1.1 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.377 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 18.6 p -155.29 131.92 10.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.528 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.8 pmm? -101.87 -176.67 3.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 121.073 0.463 . . . . 0.0 109.921 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 10.8 t70 -75.25 126.04 30.19 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.361 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.97 -45.52 90.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.046 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HB3' ' OD1' ' A' ' 2' ' ' ASP . 0.4 OUTLIER -62.56 -39.84 94.93 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.777 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.807 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -67.1 -57.47 6.73 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.356 0.598 . . . . 0.0 110.627 178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.559 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 3.6 tmm_? -58.9 -34.25 71.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.452 -0.794 . . . . 0.0 112.055 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -76.26 -48.67 19.4 Favored 'General case' 0 C--O 1.208 -1.103 0 CA-C-O 119.03 -0.51 . . . . 0.0 111.31 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.0 m -55.73 -23.07 26.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.837 0.744 . . . . 0.0 110.128 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.634 ' HA ' ' CD2' ' A' ' 87' ' ' LEU . 2.5 tp -71.65 -58.19 3.71 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.584 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.734 HD23 ' HG ' ' A' ' 16' ' ' LEU . 13.6 mt -86.41 -15.34 40.64 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -70.01 -33.56 72.17 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.157 0.503 . . . . 0.0 109.703 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -85.93 41.64 0.93 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 6.4 ttp180 -52.82 -26.88 15.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.927 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.2 tp10 -57.65 -25.89 60.82 Favored 'General case' 0 C--N 1.334 -0.074 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.76 -28.16 7.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.057 178.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.734 ' HG ' HD23 ' A' ' 10' ' ' LEU . 2.4 tm? -49.75 -82.58 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 123.501 0.721 . . . . 0.0 110.921 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' HG22 ' A' ' 20' ' ' ILE . 61.8 tt0 -68.74 1.09 3.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.099 0.476 . . . . 0.0 112.149 -178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -83.25 -45.15 14.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -123.84 -0.29 8.53 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 17' ' ' GLU . 12.7 tt -66.81 106.88 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-O 122.059 0.933 . . . . 0.0 110.201 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.497 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 17.1 tttp -98.17 156.0 16.89 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.858 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.548 ' HA ' HD22 ' A' ' 56' ' ' LEU . 4.8 t -122.14 0.51 9.61 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.9 m -81.97 -85.79 0.1 Allowed 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.693 -0.629 . . . . 0.0 112.192 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -62.25 -40.34 95.87 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.688 HD13 HD23 ' A' ' 75' ' ' LEU . 92.0 mt -57.56 -45.72 86.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.527 0.679 . . . . 0.0 110.776 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.67 ' O ' HG13 ' A' ' 30' ' ' ILE . 9.2 ttt -76.16 -18.85 58.93 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.216 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.1 -40.9 62.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.507 0.67 . . . . 0.0 109.575 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.525 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 87.4 m-70 -74.73 -26.56 59.88 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.161 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.633 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 23.8 ttt -77.43 -30.8 53.59 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.583 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.67 HG13 ' O ' ' A' ' 26' ' ' MET . 43.3 mt -78.13 -42.34 27.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 73.4 p -65.03 -25.37 67.81 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.9 t70 -72.88 -29.07 62.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.754 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.19 -0.24 47.43 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.05 -1.071 . . . . 0.0 113.937 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -79.3 -35.52 41.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.755 0.777 . . . . 0.0 109.568 179.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.633 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 28.2 mt -98.96 113.89 26.27 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.7 p -84.77 -172.5 4.21 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.466 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 53.7 mt -63.66 -31.91 54.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 m -65.85 -41.96 91.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.934 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.542 ' HG2' HD22 ' A' ' 35' ' ' LEU . 5.4 mp0 -68.94 -45.17 71.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.447 0.642 . . . . 0.0 109.331 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -58.73 -50.86 72.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.005 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -54.01 -57.24 11.79 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -57.06 -50.89 71.37 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HG2' ' A' ' 55' ' ' MET . 58.7 t -59.38 -43.29 89.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.383 0.611 . . . . 0.0 110.558 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -28.56 60.13 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.493 -179.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.413 ' HA ' HD22 ' A' ' 45' ' ' ASN . 1.3 m120 -65.19 -36.48 84.33 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 51' ' ' GLN . 50.1 mm-40 -57.12 153.75 23.46 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.866 -179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.74 -73.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.742 2.961 . . . . 0.0 114.815 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.0 p -134.96 -171.27 2.75 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 20.4 tt0 -45.35 -26.79 0.57 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.759 0.662 . . . . 0.0 112.372 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -46.93 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 120.923 0.392 . . . . 0.0 110.602 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.513 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 0.0 OUTLIER -87.16 -12.32 47.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.725 179.369 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.497 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 17.1 ttp180 -73.76 -54.9 7.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.737 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.56 -41.87 79.13 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.59 -30.57 69.9 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.72 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.697 ' O ' ' HG3' ' A' ' 59' ' ' MET . 59.5 tpp -69.48 -38.09 77.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.548 HD22 ' HA ' ' A' ' 22' ' ' THR . 11.2 tp -64.77 -53.72 42.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.802 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 53' ' ' ALA . 2.5 mt -61.13 -30.7 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.995 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -72.83 -35.89 67.39 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.845 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.697 ' HG3' ' O ' ' A' ' 55' ' ' MET . 18.8 mtm -59.06 -51.85 68.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.035 0.445 . . . . 0.0 110.254 178.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 2.1 mp -60.63 -36.87 73.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.685 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 tt -56.96 -37.31 71.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.003 0.43 . . . . 0.0 110.647 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 62' ' ' LYS . 45.9 tptt -114.92 39.44 2.87 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.41 0.624 . . . . 0.0 111.305 -179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 59' ' ' MET . 34.7 tptt -120.09 -122.24 0.29 Allowed 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -161.28 175.66 12.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 118.109 0.413 . . . . 0.0 110.982 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.697 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 1.1 p30 -61.62 -30.71 70.87 Favored 'General case' 0 CA--C 1.508 -0.642 0 O-C-N 123.671 0.607 . . . . 0.0 112.062 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -62.62 -46.67 87.21 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.546 -0.862 . . . . 0.0 109.426 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.06 -26.83 56.92 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.313 0.577 . . . . 0.0 109.91 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.807 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 30.5 t80 -66.57 -43.35 85.23 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.972 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.9 t -69.23 -29.57 43.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.2 t -69.64 -51.26 36.45 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.402 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 26.4 t80 -58.88 -37.39 76.44 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.694 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 21.3 t80 -59.02 -48.01 83.15 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.098 0.951 . . . . 0.0 109.002 176.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 -58.01 -41.39 83.03 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 113.784 -1.553 . . . . 0.0 111.106 179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.2 -34.8 78.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.24 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.688 HD23 HD13 ' A' ' 25' ' ' ILE . 43.9 mt -65.76 -28.51 69.09 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.7 mp -83.25 -15.83 48.76 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.953 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -77.89 -31.77 51.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -104.94 -155.68 0.55 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.452 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -101.11 46.38 1.31 Allowed Glycine 0 C--N 1.313 -0.699 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.519 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.497 ' OH ' ' HD2' ' A' ' 21' ' ' LYS . 80.1 m-85 -129.71 39.69 3.68 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 122.073 0.94 . . . . 0.0 110.547 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -74.12 -11.29 60.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.316 -1.311 . . . . 0.0 110.882 179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.24 -48.87 14.84 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.629 ' O ' ' HG ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -59.93 -45.83 91.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 178.315 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.694 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -64.0 -31.27 72.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.16 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.09 -34.47 76.47 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.8 mt -65.23 -14.49 60.79 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.988 177.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.73 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 3.2 mt -111.97 -12.32 13.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.733 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -53.55 -32.48 50.9 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.647 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -67.94 -34.3 76.32 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -76.25 -34.04 47.27 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.595 178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.1 118.8 67.11 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 117.227 0.513 . . . . 0.0 110.299 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.14 -51.79 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.092 2.528 . . . . 0.0 112.508 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -154.31 142.89 13.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.471 ' HA ' HG11 ' A' ' 69' ' ' VAL . 10.6 t -93.8 67.59 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.438 0.637 . . . . 0.0 110.373 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.0 m -96.69 -7.97 32.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.881 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.6 m -81.37 67.61 7.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.64 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.437 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.041 -0.423 . . . . 0.0 112.041 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -85.71 73.17 3.93 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.553 2.169 . . . . 0.0 112.975 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -127.68 71.78 1.37 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.556 0.693 . . . . 0.0 110.561 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 99.52 32.58 5.67 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.676 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 7.7 t -157.59 174.49 15.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.544 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pmm? -77.85 175.38 10.06 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.539 0.685 . . . . 0.0 111.307 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.99 132.63 46.22 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.445 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.37 -42.46 98.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.295 -178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -66.21 -35.27 80.01 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.919 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -70.72 -55.58 8.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.415 0.626 . . . . 0.0 110.05 178.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.544 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 5.5 tmm_? -58.27 -38.47 77.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.758 -179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -71.06 -50.21 36.3 Favored 'General case' 0 C--O 1.204 -1.292 0 CA-C-O 119.064 -0.494 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 96.3 m -54.36 -25.5 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.423 0.63 . . . . 0.0 110.468 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.959 ' HA ' HD11 ' A' ' 87' ' ' LEU . 1.5 tp -68.69 -55.76 10.35 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.466 178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.825 ' HA ' HD13 ' A' ' 16' ' ' LEU . 17.5 mt -82.14 -23.62 35.51 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.984 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 13' ' ' ARG . 7.8 tt0 -66.63 -27.37 67.63 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 123.196 0.598 . . . . 0.0 110.521 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.461 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 68.5 m-70 -90.93 41.86 1.08 Allowed 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.715 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -54.74 -22.69 14.84 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.106 179.051 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -58.96 -29.02 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.93 -8.18 9.85 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.96 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.825 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.7 tp -52.38 -87.24 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.063 0.227 . . . . 0.0 111.497 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.32 -24.41 59.58 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.928 0.394 . . . . 0.0 111.45 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.52 -48.97 62.98 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -107.36 -23.07 12.35 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.533 HD12 ' HG ' ' A' ' 16' ' ' LEU . 16.8 mt -68.44 95.02 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.956 0.884 . . . . 0.0 110.282 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HE2' ' HE2' ' A' ' 80' ' ' TYR . 34.6 ttpt -80.02 149.43 30.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.285 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.817 ' HA ' HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -103.74 -64.51 1.09 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -177.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 22' ' ' THR . 15.0 m -34.95 -77.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -177.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -68.28 -36.61 79.64 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.733 HD13 HD23 ' A' ' 75' ' ' LEU . 28.5 mt -60.57 -39.58 81.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.212 0.529 . . . . 0.0 110.142 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.737 ' O ' HG13 ' A' ' 30' ' ' ILE . 19.3 ttp -73.16 -28.38 62.19 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.433 178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -63.79 -35.05 79.32 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -74.49 -33.74 62.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.502 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.411 ' HB3' ' HG ' ' A' ' 35' ' ' LEU . 44.7 mtp -68.15 -35.51 78.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.068 0.461 . . . . 0.0 111.207 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.737 HG13 ' O ' ' A' ' 26' ' ' MET . 16.3 mt -77.19 -31.21 18.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 t -66.79 -25.1 66.3 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.595 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 67.9 m-20 -79.23 -25.62 42.59 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.095 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.14 6.03 65.26 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.308 -0.949 . . . . 0.0 112.29 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 10.1 m-85 -79.03 -36.17 41.51 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.127 0.489 . . . . 0.0 109.927 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 30' ' ' ILE . 55.1 mt -97.73 127.54 43.75 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 37' ' ' ILE . 0.9 OUTLIER -87.56 177.11 7.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.103 -178.601 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.646 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.4 mp -56.76 -38.35 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.534 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 m -65.65 -43.03 90.66 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 109.876 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' O ' HG23 ' A' ' 43' ' ' VAL . 7.5 mp0 -59.72 -49.39 77.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.651 177.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB2' HD13 ' A' ' 30' ' ' ILE . 35.0 tt0 -59.11 -48.89 79.94 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.512 178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -51.23 -53.14 38.03 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.276 -0.875 . . . . 0.0 113.16 -178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 1.004 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -62.74 -49.81 73.58 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.009 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.585 HG22 ' HG3' ' A' ' 55' ' ' MET . 34.2 t -58.85 -43.65 88.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.38 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 -74.87 -23.12 58.35 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.582 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.484 HD22 ' HA ' ' A' ' 45' ' ' ASN . 0.5 OUTLIER -62.72 -46.98 85.61 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.833 0.349 . . . . 0.0 111.63 -179.303 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.474 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 2.7 mm-40 -54.46 143.59 46.43 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.141 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 3.7 Cg_endo -89.34 -19.72 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.204 2.602 . . . . 0.0 115.444 -177.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 17.7 p -136.49 166.57 23.2 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 118.715 0.689 . . . . 0.0 110.277 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HG3' ' HB2' ' A' ' 53' ' ' ALA . 11.5 tt0 -52.84 -23.23 6.56 Favored 'General case' 0 CA--C 1.523 -0.077 0 O-C-N 123.53 0.519 . . . . 0.0 109.939 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -36.98 -81.58 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 124.584 1.178 . . . . 0.0 110.864 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 17.3 mt-30 -96.39 -2.71 45.03 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.336 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.738 ' HB3' HG21 ' A' ' 22' ' ' THR . 62.2 mtt180 -70.21 -57.17 5.21 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.648 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.0 -43.55 78.63 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.72 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -58.48 -34.07 70.49 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.692 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.677 ' O ' ' HG3' ' A' ' 59' ' ' MET . 36.7 tpp -70.82 -38.51 73.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 118.146 0.43 . . . . 0.0 110.493 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' A' ' 22' ' ' THR . 19.7 tp -65.66 -51.23 61.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ALA . 12.9 mt -65.96 -31.96 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.637 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 51.3 tttm -65.31 -39.57 92.66 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.441 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.677 ' HG3' ' O ' ' A' ' 55' ' ' MET . 21.4 mtm -60.7 -48.73 80.46 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 56' ' ' LEU . 4.6 mm -63.37 -19.08 23.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.142 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 6.1 tt -71.59 -21.89 61.8 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.775 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -143.59 49.34 1.41 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.446 0.641 . . . . 0.0 112.353 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 59' ' ' MET . 61.3 mmtt -115.17 -117.29 0.32 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -161.51 164.16 29.79 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.723 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 7.8 p30 -59.9 -26.39 65.86 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 123.447 0.467 . . . . 0.0 110.855 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -60.21 -52.54 64.87 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.458 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.7 OUTLIER -73.87 -28.44 61.58 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.083 0.468 . . . . 0.0 110.356 178.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.919 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 10.7 t80 -67.3 -39.94 85.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.297 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.7 t -70.72 -29.15 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.0 t -69.07 -48.94 61.43 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -58.1 -37.73 75.08 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.607 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.5 t80 -60.49 -47.88 84.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.362 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -60.35 -40.33 90.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.501 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.445 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -63.2 -32.49 73.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HD13 ' A' ' 25' ' ' ILE . 81.7 mt -64.22 -41.85 96.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.624 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.1 mp -68.38 -19.46 64.62 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.623 177.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -79.8 -36.05 37.58 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.748 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -106.35 38.89 1.93 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.767 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.71 37.32 92.19 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 116.589 1.395 . . . . 0.0 116.589 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.577 ' HE2' ' HE2' ' A' ' 21' ' ' LYS . 58.4 m-85 -120.09 59.24 0.89 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.603 1.202 . . . . 0.0 110.178 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.624 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 mtmt -77.49 -17.08 58.33 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.15 -179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -79.27 -44.87 20.88 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.707 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.627 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -63.74 -45.14 91.22 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 178.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.2 -36.91 81.17 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.095 178.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.99 -34.47 78.07 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 83' ' ' LEU . 50.2 mt -63.89 -20.19 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.617 178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.959 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.9 mp -108.62 -10.59 15.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.537 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.525 ' NE2' ' HA ' ' A' ' 94' ' ' VAL . 12.3 t-160 -58.61 -27.17 64.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.278 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.95 -22.5 65.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.321 0.582 . . . . 0.0 110.015 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.617 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -98.86 -23.64 11.54 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.958 178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.547 HG23 HG22 ' A' ' 69' ' ' VAL . 47.4 mm -73.99 121.61 85.6 Favored Pre-proline 0 N--CA 1.45 -0.427 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.17 -30.02 91.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.724 2.283 . . . . 0.0 111.891 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 91' ' ' ILE . 48.1 t -81.76 103.5 8.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.017 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.525 ' HA ' ' NE2' ' A' ' 88' ' ' HIS . 5.9 p -123.06 76.29 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 122.024 0.916 . . . . 0.0 110.295 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.8 t -166.22 167.16 16.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.058 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.6 t -82.82 -171.5 3.57 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.252 1.213 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.312 -179.821 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -74.83 95.57 0.97 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.846 2.364 . . . . 0.0 112.786 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' -3' ' ' LEU . 2.1 tm? -88.61 119.84 29.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -171.58 146.44 9.46 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.888 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 49.4 m -70.21 -161.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.728 0.299 . . . . 0.0 111.129 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE2' ' HB2' ' A' ' 68' ' ' TYR . 5.1 ptp -71.0 -164.46 0.1 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 38.8 t70 -73.71 131.67 41.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.074 0.464 . . . . 0.0 111.228 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.55 -45.59 93.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.099 -179.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.757 0.313 . . . . 0.0 110.19 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.815 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -68.42 -54.37 17.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.133 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.421 ' HD3' ' HG2' ' A' ' 1' ' ' MET . 51.6 ttp85 -63.48 -27.86 69.56 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.933 -178.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -78.12 -50.2 12.45 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.652 179.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.7 m -56.61 -22.67 35.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.404 0.621 . . . . 0.0 110.658 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.017 ' HA ' HD11 ' A' ' 87' ' ' LEU . 4.7 tp -72.92 -58.24 3.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.6 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.86 ' HA ' HD13 ' A' ' 16' ' ' LEU . 46.5 mt -78.3 -27.28 47.25 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.56 -178.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.4 tt0 -60.57 -38.36 84.32 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.322 0.649 . . . . 0.0 110.937 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -82.94 42.69 0.81 Allowed 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.546 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -48.65 -39.35 23.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.659 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.04 -21.43 61.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.91 0.386 . . . . 0.0 110.656 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.85 -18.88 13.0 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.86 HD13 ' HA ' ' A' ' 10' ' ' LEU . 2.4 tp -52.15 -85.04 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.962 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.26 -7.26 8.73 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -85.15 -45.1 12.36 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.255 -0.278 . . . . 0.0 111.309 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -109.96 -23.37 11.37 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.636 HG21 HG12 ' A' ' 57' ' ' ILE . 20.9 mt -71.91 90.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.86 152.39 18.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.653 -178.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.679 ' HA ' HD22 ' A' ' 56' ' ' LEU . 1.6 t -90.39 -101.86 0.1 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.313 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.66 ' H ' HG23 ' A' ' 22' ' ' THR . 23.6 m 26.18 -91.03 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -71.53 -45.95 60.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.698 HD13 HD23 ' A' ' 75' ' ' LEU . 59.0 mt -57.72 -40.81 77.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.737 0.78 . . . . 0.0 109.71 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' HG13 ' A' ' 30' ' ' ILE . 7.0 ttt -71.25 -27.68 63.63 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.56 178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -70.1 -36.89 75.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.603 0.715 . . . . 0.0 109.996 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.53 -33.09 70.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.463 178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 19.0 mtp -70.36 -36.82 74.41 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 112.065 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 26' ' ' MET . 23.2 mt -78.33 -41.63 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.0 t -66.14 -23.17 66.43 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -74.89 -28.54 60.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.65 0.35 49.46 Favored Glycine 0 C--N 1.336 0.551 0 C-N-CA 120.545 -0.836 . . . . 0.0 113.261 178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -80.89 -22.52 39.71 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.125 0.488 . . . . 0.0 110.956 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.463 HD11 ' HE1' ' A' ' 59' ' ' MET . 48.6 mt -110.7 134.96 52.0 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.1 p -96.16 172.75 7.78 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.134 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.0 mt -57.78 -34.28 47.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.915 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 p -67.62 -35.86 79.73 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.094 0.474 . . . . 0.0 110.415 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 43' ' ' VAL . 5.5 mm-40 -70.7 -45.02 65.77 Favored 'General case' 0 C--O 1.231 0.099 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HA ' ' HE3' ' A' ' 26' ' ' MET . 42.4 tt0 -57.79 -51.55 69.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.055 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 6.5 tm-20 -53.12 -56.43 16.31 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.915 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.74 ' HA ' HD22 ' A' ' 45' ' ' ASN . 22.8 ttmm -61.94 -51.08 69.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -177.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.648 HG22 ' HG3' ' A' ' 55' ' ' MET . 72.8 t -54.21 -44.17 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 118.184 0.447 . . . . 0.0 111.599 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -85.35 -24.1 27.75 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.74 HD22 ' HA ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -75.6 -29.01 59.12 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.763 -0.586 . . . . 0.0 112.524 -178.356 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HB3' ' HD2' ' A' ' 47' ' ' PRO . 4.9 mm-40 -61.9 158.88 40.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.499 ' HB2' ' H ' ' A' ' 48' ' ' THR . 50.2 Cg_exo -28.52 -91.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.087 1 C-N-CA 125.79 4.326 . . . . 0.0 116.314 -177.542 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.499 ' H ' ' HB2' ' A' ' 47' ' ' PRO . 24.2 p -132.48 -167.12 1.84 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HA ' ' HB2' ' A' ' 52' ' ' ARG . 27.4 tt0 -50.53 -25.44 4.08 Favored 'General case' 0 C--O 1.222 -0.347 0 O-C-N 123.484 0.49 . . . . 0.0 110.205 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -47.2 -66.82 0.35 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.66 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 55' ' ' MET . 22.3 tt0 -91.16 -11.44 38.43 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.821 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.653 ' HB2' ' HA ' ' A' ' 49' ' ' GLN . 99.1 mtt180 -77.45 -52.54 8.93 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.557 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.92 -42.07 85.99 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 176.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.34 -34.17 74.83 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.897 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.648 ' HG3' HG22 ' A' ' 43' ' ' VAL . 57.6 tpp -70.31 -39.54 74.75 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 ' HA ' ' A' ' 22' ' ' THR . 23.0 tp -60.89 -53.01 62.48 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.586 0.707 . . . . 0.0 109.424 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.636 HG12 HG21 ' A' ' 20' ' ' ILE . 23.0 mt -63.97 -33.01 59.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.117 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -66.14 -37.55 85.96 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.578 179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.754 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 22.5 mtm -58.4 -59.71 4.92 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.448 HG23 ' HE1' ' A' ' 1' ' ' MET . 2.4 mp -57.4 -33.73 44.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.265 -0.879 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 61' ' ' LEU . 8.1 tt -54.02 -34.33 59.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.51 178.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -118.63 37.98 3.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.796 0.332 . . . . 0.0 111.867 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.754 ' HE2' ' HB3' ' A' ' 59' ' ' MET . 62.3 mttm -121.06 -162.15 0.94 Allowed 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.167 -0.333 . . . . 0.0 110.789 178.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -117.57 177.67 4.67 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 69' ' ' VAL . 9.4 t-20 -53.96 -44.65 70.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 113.466 -1.697 . . . . 0.0 111.853 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -58.87 -43.74 90.95 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -30.68 62.7 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.371 0.605 . . . . 0.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.815 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 23.6 t80 -66.3 -43.57 85.93 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.368 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 65' ' ' ASN . 20.6 t -68.47 -29.33 43.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' A' ' 73' ' ' ASN . 41.8 t -69.59 -49.87 49.99 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -57.89 -37.72 74.51 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 60.4 t80 -60.59 -48.48 81.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.085 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 70' ' ' SER . 35.1 t-20 -56.39 -44.77 80.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.524 178.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.64 72.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.147 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.698 HD23 HD13 ' A' ' 25' ' ' ILE . 89.8 mt -67.15 -38.85 86.19 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.74 -13.37 60.95 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.846 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -82.84 -30.87 28.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -116.35 39.06 3.21 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.39 29.67 73.99 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 115.942 1.137 . . . . 0.0 115.942 176.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CD2' HD11 ' A' ' 25' ' ' ILE . 80.9 m-85 -114.71 45.78 1.51 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 118.437 1.119 . . . . 0.0 110.028 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -67.78 -30.01 69.35 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.489 -179.596 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -67.77 -39.74 84.08 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.3 OUTLIER -68.05 -42.86 79.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -64.38 -31.51 72.75 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.201 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -67.2 -32.02 72.8 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 83' ' ' LEU . 79.8 mt -67.24 -12.67 60.71 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.828 177.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 1.017 HD11 ' HA ' ' A' ' 9' ' ' LEU . 8.8 mp -116.27 -7.07 11.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.606 -178.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 17.6 t-160 -58.86 -32.27 69.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.503 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -66.16 -21.35 66.33 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.287 0.565 . . . . 0.0 109.975 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.66 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -92.8 -30.41 9.61 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.56 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.53 HD13 ' CE2' ' A' ' 68' ' ' TYR . 49.6 mm -67.42 132.82 93.04 Favored Pre-proline 0 C--N 1.33 -0.273 0 C-N-CA 122.603 0.361 . . . . 0.0 110.441 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 13.1 Cg_exo -70.24 -147.91 0.02 OUTLIER 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.121 2.548 . . . . 0.0 112.5 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.96 111.44 19.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.037 0.446 . . . . 0.0 111.25 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.4 m -95.72 73.46 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.884 0.85 . . . . 0.0 109.749 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 22.9 t -89.0 115.03 26.26 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.706 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 t -94.02 -33.79 13.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.246 0.92 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.263 179.083 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.051 -0.419 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -82.14 162.75 17.81 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.594 2.196 . . . . 0.0 112.682 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -92.0 98.28 11.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.942 0.401 . . . . 0.0 110.683 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 169.04 42.83 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.16 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 48.6 m -104.15 77.37 1.42 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.705 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 10.9 ttm -103.72 140.64 37.32 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 121.709 -0.62 . . . . 0.0 109.424 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ALA . 10.6 t70 -65.25 131.28 46.08 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 7' ' ' ASN . . . -59.86 -38.51 82.35 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.27 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.3 tttm -77.19 -22.34 52.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.97 0.414 . . . . 0.0 109.888 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -81.03 -58.19 3.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.055 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.705 ' HB2' ' HG2' ' A' ' 1' ' ' MET . 39.8 ttp180 -57.53 -33.66 68.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.798 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 3' ' ' ALA . 13.9 m-20 -72.36 -54.51 9.22 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.254 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -49.95 -26.81 4.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 118.201 0.455 . . . . 0.0 111.236 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.69 ' HA ' HD22 ' A' ' 87' ' ' LEU . 5.9 tp -79.23 -55.7 4.9 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.02 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' LEU . 37.6 mt -78.86 -31.23 45.54 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -63.96 -34.43 77.97 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.89 0.476 . . . . 0.0 111.002 -179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.7 m-70 -84.8 37.14 0.64 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 1.015 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.38 -15.05 22.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.643 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -64.34 -23.53 67.33 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.23 -10.0 9.03 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.418 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.066 ' HG ' HD12 ' A' ' 20' ' ' ILE . 3.5 tt -51.16 -82.89 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.232 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -55.23 -31.06 61.19 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -63.59 -50.66 68.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -107.99 -24.95 11.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 1.066 HD12 ' HG ' ' A' ' 16' ' ' LEU . 37.8 mt -75.75 85.56 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HD2' ' OH ' ' A' ' 80' ' ' TYR . 57.8 mttt -91.49 172.33 8.58 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 178.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.634 HG23 ' H ' ' A' ' 23' ' ' SER . 2.7 t -116.8 -104.65 0.4 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.642 -178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.634 ' H ' HG23 ' A' ' 22' ' ' THR . 36.4 m 31.78 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -64.06 -46.01 86.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.794 0.438 . . . . 0.0 112.002 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.697 HD13 HD23 ' A' ' 75' ' ' LEU . 63.2 mt -59.4 -41.3 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.579 0.704 . . . . 0.0 109.703 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.725 ' O ' HG13 ' A' ' 30' ' ' ILE . 10.4 ttt -67.41 -28.54 67.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.725 178.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -66.63 -40.27 88.69 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.537 0.684 . . . . 0.0 109.181 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 91.2 m-70 -70.31 -26.22 63.67 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.999 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 18.1 mtp -75.61 -32.49 60.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 110.934 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.725 HG13 ' O ' ' A' ' 26' ' ' MET . 18.3 mt -79.26 -42.98 23.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HG ' ' HA ' ' A' ' 28' ' ' HIS . 35.7 p -65.91 -27.75 68.43 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.502 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.602 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 1.3 t0 -67.3 -29.15 68.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.02 -0.91 57.57 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.234 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 67' ' ' SER . 6.9 m-85 -81.33 -33.32 32.57 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.634 0.73 . . . . 0.0 109.711 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.871 HD21 ' HE1' ' A' ' 59' ' ' MET . 6.5 mp -103.9 117.13 33.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 38' ' ' SER . 15.1 t -90.25 -175.18 4.43 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.208 -178.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.3 mm -57.29 -36.91 54.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.748 0.309 . . . . 0.0 110.375 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.505 ' H ' HG23 ' A' ' 36' ' ' THR . 67.4 m -68.27 -36.1 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.431 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.661 ' HA ' ' HE2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.12 -44.03 80.92 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.382 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HA ' ' CE ' ' A' ' 26' ' ' MET . 35.4 tt0 -59.23 -48.77 80.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.454 -1.248 . . . . 0.0 109.726 178.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -53.38 -43.29 67.71 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.37 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 39' ' ' GLU . 47.3 mtmt -67.01 -59.3 3.59 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 121.327 0.584 . . . . 0.0 111.986 -179.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.644 ' O ' ' HG3' ' A' ' 52' ' ' ARG . 63.8 t -57.91 -34.32 48.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HA ' ' NH1' ' A' ' 52' ' ' ARG . 22.3 mtt-85 -82.28 -19.79 38.82 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.312 178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.61 -41.13 98.81 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.996 0.427 . . . . 0.0 110.173 -179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.564 ' HG3' ' CB ' ' A' ' 51' ' ' GLN . 6.2 mm-40 -65.31 146.45 98.95 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.789 178.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 14.0 Cg_exo -72.91 -33.91 7.22 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.466 2.777 . . . . 0.0 116.61 -175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 20.5 p -140.86 176.04 9.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 119.311 0.96 . . . . 0.0 110.978 -178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.602 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 25.3 tt0 -51.36 -23.45 3.73 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 123.788 0.68 . . . . 0.0 110.278 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.897 HE21 ' HG3' ' A' ' 51' ' ' GLN . 26.7 tt0 -39.24 -78.97 0.02 OUTLIER 'General case' 0 C--O 1.232 0.171 0 O-C-N 124.093 0.871 . . . . 0.0 110.258 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.912 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 39.4 mt-30 -97.35 0.34 47.76 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 119.764 -0.774 . . . . 0.0 110.182 178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.644 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 48.9 ttm-85 -72.16 -53.38 12.85 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 176.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.12 -39.72 78.74 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.912 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -61.74 -36.28 80.55 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.056 178.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.656 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.3 tpt -70.67 -40.09 73.18 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.0 110.311 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.8 tp -61.43 -48.94 78.88 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.957 0.884 . . . . 0.0 108.617 178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.773 HD11 HG21 ' A' ' 20' ' ' ILE . 31.0 mm -71.37 -17.82 19.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.066 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -82.27 -34.41 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.982 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.871 ' HE1' HD21 ' A' ' 35' ' ' LEU . 21.7 mtm -61.52 -55.21 33.55 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.519 HG23 ' HE1' ' A' ' 1' ' ' MET . 42.7 mt -55.77 -38.08 49.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.261 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.415 HD23 ' O ' ' A' ' 61' ' ' LEU . 7.1 tt -49.28 -35.75 18.77 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.194 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 36.87 4.42 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.864 -0.735 . . . . 0.0 112.719 179.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -124.72 -157.8 0.79 Allowed 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.399 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' C ' ' HE2' ' A' ' 1' ' ' MET . 3.9 m-20 -99.33 154.65 18.03 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.706 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.1 p30 -61.94 -21.88 65.15 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.059 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -59.48 -45.93 90.25 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.576 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -72.22 -27.75 62.72 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.332 177.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.846 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 16.3 t80 -68.0 -39.3 83.24 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.974 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.706 HG23 ' O ' ' A' ' 65' ' ' ASN . 4.5 t -70.95 -28.89 34.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.7 t -69.8 -51.05 37.09 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HE2' HD13 ' A' ' 9' ' ' LEU . 15.0 t80 -54.75 -40.63 69.52 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.5 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 78.1 t80 -55.97 -49.82 72.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.791 178.014 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -60.43 -35.13 75.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.097 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.485 ' CB ' HG23 ' A' ' 25' ' ' ILE . . . -67.9 -32.42 72.89 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.697 HD23 HD13 ' A' ' 25' ' ' ILE . 91.7 mt -66.52 -39.08 88.45 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.658 ' HG ' ' HG2' ' A' ' 81' ' ' LYS . 10.7 mp -73.46 -12.19 60.71 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -85.68 -33.29 21.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.188 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -115.38 40.11 2.79 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.64 29.28 72.79 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 116.783 1.473 . . . . 0.0 116.783 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.605 ' CD2' HD11 ' A' ' 25' ' ' ILE . 81.2 m-85 -124.15 50.07 1.7 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 118.773 1.287 . . . . 0.0 109.24 178.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.658 ' HG2' ' HG ' ' A' ' 76' ' ' LEU . 7.7 mtmp? -74.05 -22.72 59.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.95 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -75.74 -42.19 51.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.141 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.688 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -63.57 -45.0 92.46 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.091 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.5 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.75 -34.22 76.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.762 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.64 -34.55 78.55 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 83' ' ' LEU . 20.0 mt -63.57 -24.71 67.92 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.351 177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.786 ' HB3' ' OH ' ' A' ' 68' ' ' TYR . 4.8 mt -95.66 -16.44 22.03 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.233 -178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.595 ' HD2' ' HB ' ' A' ' 91' ' ' ILE . 7.5 t-160 -62.53 -16.8 57.81 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.951 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -65.81 -24.72 66.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.017 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.623 ' HA3' ' HA ' ' A' ' 5' ' ' ALA . . . -106.26 -18.71 10.8 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.372 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.595 ' HB ' ' HD2' ' A' ' 88' ' ' HIS . 44.2 mm -76.04 113.91 32.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.86 -7.23 20.11 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.781 2.321 . . . . 0.0 112.621 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.558 ' H ' HG22 ' A' ' 91' ' ' ILE . 57.7 t -79.59 98.99 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.148 0.499 . . . . 0.0 109.985 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.1 p -135.62 38.4 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 122.617 1.198 . . . . 0.0 109.219 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.4 p -83.64 -71.42 0.5 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.637 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 55.9 m -125.07 86.14 2.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.572 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.452 -0.785 . . . . 0.0 110.273 -179.704 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 N-CA-C 112.152 -0.379 . . . . 0.0 112.152 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -87.3 123.11 1.86 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.281 2.654 . . . . 0.0 112.543 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 8.3 mp -106.42 97.4 7.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.969 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -110.68 -77.23 0.9 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.486 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.683 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 49.4 m -140.52 157.52 45.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.813 0.339 . . . . 0.0 110.568 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.634 ' HB3' ' N ' ' A' ' 65' ' ' ASN . 0.0 OUTLIER -76.5 -166.03 0.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.281 0.563 . . . . 0.0 111.713 -179.62 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.542 ' OD2' ' HB2' ' A' ' 4' ' ' LYS . 30.4 t70 -70.96 134.4 47.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.493 -179.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -38.2 88.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.1 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HB2' ' OD2' ' A' ' 2' ' ' ASP . 12.6 mptt -67.56 -43.76 79.85 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.813 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -64.89 -51.68 60.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.259 0.552 . . . . 0.0 109.751 178.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.14 -32.8 71.36 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.988 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.7 m-20 -74.93 -50.3 17.25 Favored 'General case' 0 C--O 1.208 -1.094 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.064 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.8 m -52.86 -24.47 9.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.191 0.52 . . . . 0.0 110.307 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 1.018 ' HA ' HD11 ' A' ' 87' ' ' LEU . 6.8 tp -74.0 -62.41 1.51 Allowed 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.181 178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.545 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 16.2 mt -82.97 -24.88 32.76 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.409 ' C ' ' H ' ' A' ' 13' ' ' ARG . 7.3 tt0 -64.71 -31.41 72.62 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.983 0.513 . . . . 0.0 109.816 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -83.14 41.61 0.77 Allowed 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.236 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 10' ' ' LEU . 0.9 OUTLIER -45.01 -31.22 1.23 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.648 177.604 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -51.17 -30.47 16.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.345 178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -125.28 -17.23 5.71 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.363 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.64 HD11 HG21 ' A' ' 57' ' ' ILE . 2.2 tm? -49.5 -83.54 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.21 0.204 . . . . 0.0 111.232 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.96 -12.36 48.89 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -82.05 -34.35 29.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -115.1 -28.84 6.84 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.604 HD13 HG12 ' A' ' 57' ' ' ILE . 3.8 tt -55.98 123.1 6.26 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-O 122.048 0.928 . . . . 0.0 109.544 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -134.67 161.7 34.38 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.997 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.575 HG23 ' H ' ' A' ' 23' ' ' SER . 1.7 t -102.73 -103.34 0.28 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 120.661 -0.415 . . . . 0.0 111.172 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.575 ' H ' HG23 ' A' ' 22' ' ' THR . 44.1 m 26.41 -96.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 179.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -63.27 -47.62 81.6 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.601 HD13 HD23 ' A' ' 75' ' ' LEU . 71.9 mt -59.48 -39.42 79.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 109.923 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.762 ' HE2' HD11 ' A' ' 30' ' ' ILE . 19.2 ttt -76.81 -19.68 57.27 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.164 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.48 -38.15 74.33 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.753 0.787 . . . . 0.0 108.999 -179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.07 -34.91 69.08 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.321 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.615 ' HB3' HD13 ' A' ' 35' ' ' LEU . 27.6 mtp -66.4 -39.06 88.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.716 0.293 . . . . 0.0 111.74 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.762 HD11 ' HE2' ' A' ' 26' ' ' MET . 12.9 mt -77.26 -36.74 24.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -65.41 -30.19 70.97 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.421 178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.555 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 7.0 m-20 -73.99 -26.34 60.4 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.69 5.67 58.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.872 179.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.555 ' CD1' ' HB3' ' A' ' 32' ' ' ASP . 16.4 m-85 -79.95 -22.45 42.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.808 0.813 . . . . 0.0 109.09 179.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.722 HD21 ' HE1' ' A' ' 59' ' ' MET . 7.4 mp -110.94 110.67 21.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 37' ' ' ILE . 1.3 m -78.86 170.13 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.149 -178.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.3 mm -53.49 -40.66 42.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.24 0.337 . . . . 0.0 110.606 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.8 p -70.73 -34.43 71.87 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.686 0.279 . . . . 0.0 111.109 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -69.03 -37.4 78.59 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -66.4 -49.53 66.51 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.601 178.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 37' ' ' ILE . 4.0 mm-40 -36.78 -64.92 0.32 Allowed 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.812 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 35.4 mmtm -58.83 -57.41 13.16 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.576 ' HB ' ' HE3' ' A' ' 26' ' ' MET . 32.0 t -54.99 -32.58 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.17 0.51 . . . . 0.0 110.706 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.0 ttt-85 -85.2 -37.93 19.55 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.595 ' C ' HD22 ' A' ' 45' ' ' ASN . 0.1 OUTLIER -72.37 -13.9 61.59 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -177.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.587 ' N ' HD22 ' A' ' 45' ' ' ASN . 58.3 mm-40 -72.38 160.57 82.44 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.358 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.43 -73.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.199 2.6 . . . . 0.0 116.14 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 34.9 p -131.59 -164.43 1.45 Allowed 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.099 -0.376 . . . . 0.0 111.304 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.8 -27.65 2.15 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.144 0.577 . . . . 0.0 111.572 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -50.26 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.395 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 46' ' ' GLU . 21.9 tp60 -84.04 -8.95 58.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.52 -178.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.526 ' HG2' ' HB2' ' A' ' 46' ' ' GLU . 40.5 mtp180 -82.51 -57.13 3.48 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.446 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.746 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -66.15 -44.5 83.95 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' ILE . . . -60.43 -29.83 69.25 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.02 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.628 ' O ' ' HG3' ' A' ' 59' ' ' MET . 14.7 tpt -72.96 -30.51 63.89 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.461 HD22 ' HA ' ' A' ' 22' ' ' THR . 14.3 tp -69.51 -51.93 31.24 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.746 HG13 ' O ' ' A' ' 53' ' ' ALA . 1.7 mt -61.81 -29.83 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.039 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -70.81 -40.4 72.52 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.319 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.722 ' HE1' HD21 ' A' ' 35' ' ' LEU . 18.9 mtm -56.72 -52.1 66.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.571 HG22 ' HE3' ' A' ' 1' ' ' MET . 41.3 mt -55.93 -37.1 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.568 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.27 -32.1 64.22 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.988 0.423 . . . . 0.0 110.826 178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -115.83 36.71 3.89 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.16 0.505 . . . . 0.0 110.492 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.683 ' O ' ' HA ' ' A' ' -1' ' ' SER . 33.2 mmtm -124.2 -163.96 1.2 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -130.29 178.63 6.44 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.525 0.202 . . . . 0.0 111.109 -178.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.855 ' HA ' ' HB3' ' A' ' 68' ' ' TYR . 8.3 p30 -62.18 -22.52 65.96 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.248 -178.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -63.82 -47.76 79.52 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 119.478 -0.889 . . . . 0.0 108.616 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.31 -31.22 48.73 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.043 0.449 . . . . 0.0 110.26 178.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.855 ' HB3' ' HA ' ' A' ' 65' ' ' ASN . 11.9 t80 -66.59 -43.72 84.13 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.518 -178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 65' ' ' ASN . 48.0 t -71.67 -26.71 26.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.3 t -69.42 -48.64 60.38 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.26 -40.09 80.92 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 82.1 t80 -56.89 -47.17 81.11 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.435 177.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -58.9 -37.91 77.69 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.651 179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.93 76.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.992 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.601 HD23 HD13 ' A' ' 25' ' ' ILE . 77.3 mt -65.35 -34.85 79.3 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.579 ' HG ' ' HG3' ' A' ' 81' ' ' LYS . 7.9 mp -80.82 -17.63 50.16 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.648 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -74.4 -41.39 61.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -96.79 -139.21 0.27 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.513 178.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.94 53.87 0.61 Allowed Glycine 0 CA--C 1.522 0.486 0 C-N-CA 119.742 -1.218 . . . . 0.0 114.695 -178.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.531 ' CD2' HD11 ' A' ' 25' ' ' ILE . 96.6 m-85 -135.67 46.79 2.32 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 122.001 0.905 . . . . 0.0 110.592 178.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.579 ' HG3' ' HG ' ' A' ' 76' ' ' LEU . 21.4 ttmt -71.85 -19.47 61.96 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.447 -1.251 . . . . 0.0 110.992 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -72.7 -49.77 29.23 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.782 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.627 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -59.64 -46.45 88.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.114 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.528 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -58.33 -41.91 85.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.874 178.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.5 78.15 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.925 0.393 . . . . 0.0 110.455 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.01 -26.28 68.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.209 0.528 . . . . 0.0 110.182 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 9' ' ' LEU . 6.4 mp -97.75 -11.75 23.06 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.3 t-160 -57.78 -25.84 61.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.062 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.63 -31.36 68.04 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.154 178.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.782 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -97.08 -23.26 15.24 Favored Glycine 0 CA--C 1.523 0.549 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.595 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.475 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 41.7 mm -73.4 127.29 89.16 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.558 0.218 . . . . 0.0 110.669 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 5.7 Cg_endo -84.28 37.57 0.64 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.322 2.681 . . . . 0.0 113.382 -179.089 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.1 t -116.68 113.66 43.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 m -113.17 53.86 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.22 0.533 . . . . 0.0 111.807 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 51.5 m -116.4 34.45 5.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.39 0.614 . . . . 0.0 110.466 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.4 p -109.2 114.66 28.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.082 0.467 . . . . 0.0 111.435 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.773 -1.108 . . . . 0.0 109.648 179.52 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -56.48 123.86 14.87 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.757 2.305 . . . . 0.0 112.182 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 tt -71.03 116.63 11.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.082 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -141.07 137.32 8.09 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.486 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.651 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 27.8 p -148.4 163.73 36.24 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.524 0.19 . . . . 0.0 110.79 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 0.8 OUTLIER -77.03 163.64 26.49 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 121.435 0.636 . . . . 0.0 110.395 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -74.05 155.82 38.13 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.554 ' O ' ' HB3' ' A' ' 7' ' ' ASN . . . -66.8 -48.67 68.27 Favored 'General case' 0 C--O 1.205 -1.255 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -52.97 -26.87 16.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.931 -0.481 . . . . 0.0 112.079 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HB1' ' HE2' ' A' ' 68' ' ' TYR . . . -89.35 -58.89 2.37 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 177.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.528 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 54.0 ttp180 -59.39 -28.92 67.33 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.452 0.644 . . . . 0.0 112.585 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 3' ' ' ALA . 28.8 t30 -80.38 -46.96 15.17 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.72 -178.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.5 m -57.6 -22.06 42.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.425 0.631 . . . . 0.0 109.55 177.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.787 ' HA ' HD22 ' A' ' 87' ' ' LEU . 1.9 tp -74.77 -63.5 1.24 Allowed 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.602 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.665 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 71.1 mt -72.14 -30.8 65.4 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 13' ' ' ARG . 8.2 tt0 -60.61 -33.73 73.19 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.885 0.474 . . . . 0.0 110.957 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' HB3' ' A' ' 86' ' ' LEU . 44.0 m-70 -79.75 39.4 0.42 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 121.116 0.484 . . . . 0.0 110.19 178.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.91 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . 12.3 mmt180 -46.75 -33.26 4.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.461 178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -56.11 -27.32 53.37 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.945 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.3 -15.9 10.96 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.484 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.91 ' HB2' ' HA ' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -49.67 -84.66 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.703 0.801 . . . . 0.0 111.027 179.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 16' ' ' LEU . 25.9 tp10 -59.61 -18.53 42.2 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.434 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -76.19 -47.1 25.35 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -123.66 1.82 8.86 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 -176.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.777 HG21 HG12 ' A' ' 57' ' ' ILE . 5.3 mt -76.95 86.48 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 122.285 1.04 . . . . 0.0 109.266 177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.416 ' O ' HD12 ' A' ' 25' ' ' ILE . 86.9 tttt -86.86 144.06 27.17 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.64 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.881 HG21 ' HG2' ' A' ' 52' ' ' ARG . 1.4 t -99.09 -103.51 0.22 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.573 ' H ' HG23 ' A' ' 22' ' ' THR . 42.6 t 39.56 -109.16 0.08 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -64.83 -34.0 77.33 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.855 HD13 HD23 ' A' ' 75' ' ' LEU . 51.2 mt -61.92 -40.18 86.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.715 ' O ' HG13 ' A' ' 30' ' ' ILE . 13.9 ttt -74.28 -23.66 59.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.507 177.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -73.99 -41.95 61.15 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -66.4 -33.43 75.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.813 178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.55 ' HG2' ' HG ' ' A' ' 35' ' ' LEU . 25.2 ttt -72.08 -36.25 69.46 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 26' ' ' MET . 21.9 mt -75.37 -37.46 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 t -67.43 -23.38 65.52 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.009 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -75.67 -27.93 58.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.88 2.32 52.25 Favored Glycine 0 C--N 1.336 0.583 0 C-N-CA 120.346 -0.931 . . . . 0.0 113.428 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 66' ' ' ASP . 22.2 m-85 -83.0 -22.02 33.74 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 117.547 0.674 . . . . 0.0 110.717 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.603 ' HB2' HG12 ' A' ' 30' ' ' ILE . 25.4 mt -110.14 119.15 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -83.17 176.11 9.44 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.336 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.3 mt -60.28 -35.28 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.748 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.4 p -74.25 -36.75 63.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -36.28 80.49 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -67.13 -50.29 61.89 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.977 176.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -38.28 -57.84 1.06 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.811 1.245 . . . . 0.0 113.774 -178.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -65.09 -53.19 49.38 Favored 'General case' 0 C--O 1.243 0.731 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 t -60.33 -35.16 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.47 0.652 . . . . 0.0 110.378 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -77.53 -31.12 53.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.628 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -55.92 -40.94 73.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.714 ' HG3' ' HB2' ' A' ' 51' ' ' GLN . 6.2 mm-40 -73.41 120.23 80.0 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.688 177.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 46' ' ' GLU . 6.0 Cg_exo -82.28 -1.8 10.87 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.528 2.819 . . . . 0.0 115.58 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.533 ' O ' ' HB3' ' A' ' 52' ' ' ARG . 7.4 p -138.27 169.55 17.59 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 118.795 0.725 . . . . 0.0 110.907 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.485 ' HG2' ' CB ' ' A' ' 53' ' ' ALA . 3.9 tm0? -56.02 -17.58 7.23 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.265 0.353 . . . . 0.0 110.074 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -39.27 -93.3 0.0 OUTLIER 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.754 1.222 . . . . 0.0 111.038 178.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.811 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 41.9 mt-30 -98.31 1.93 47.58 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 118.994 -1.082 . . . . 0.0 110.498 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.881 ' HG2' HG21 ' A' ' 22' ' ' THR . 18.0 ttp180 -74.65 -51.98 12.92 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 176.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 57' ' ' ILE . . . -68.69 -43.45 76.06 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.811 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -59.51 -37.14 77.52 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 120.754 -0.379 . . . . 0.0 111.827 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.593 ' O ' ' HG3' ' A' ' 59' ' ' MET . 15.2 tpt -73.09 -35.74 66.67 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.541 ' O ' HD12 ' A' ' 60' ' ' ILE . 17.7 tp -61.06 -53.63 54.7 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.786 HG21 HD11 ' A' ' 16' ' ' LEU . 24.1 mt -62.56 -28.12 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.35 178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 61' ' ' LEU . 63.0 tttp -74.68 -31.91 62.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.983 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.593 ' HG3' ' O ' ' A' ' 55' ' ' MET . 28.7 mtm -65.3 -52.58 53.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 56' ' ' LEU . 3.7 mp -66.93 -19.62 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.482 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 58' ' ' LYS . 7.6 tt -64.25 -21.23 66.51 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.204 0.526 . . . . 0.0 109.642 178.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -150.11 59.24 0.97 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.384 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.651 ' O ' ' HA ' ' A' ' -1' ' ' SER . 19.3 tptm -121.71 -111.72 0.33 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.053 -0.404 . . . . 0.0 110.797 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.525 ' O ' ' HE3' ' A' ' 1' ' ' MET . 52.1 t0 -160.73 159.76 30.56 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 -179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.651 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 p30 -61.27 -32.16 71.98 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.211 0.319 . . . . 0.0 111.109 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.572 ' HB3' ' HE2' ' A' ' 34' ' ' PHE . 65.3 m-20 -60.05 -47.9 83.94 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.04 -27.71 61.07 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.148 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.757 ' HE2' ' HB1' ' A' ' 5' ' ' ALA . 14.8 t80 -66.67 -42.03 87.18 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 65' ' ' ASN . 34.3 t -70.35 -27.9 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.6 t -70.3 -52.64 21.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -57.73 -38.54 75.47 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.645 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 35.1 t80 -58.43 -50.75 72.6 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.195 177.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -60.24 -34.9 74.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.485 -1.234 . . . . 0.0 111.604 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.27 72.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.94 0.4 . . . . 0.0 110.528 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.855 HD23 HD13 ' A' ' 25' ' ' ILE . 69.3 mt -64.34 -35.24 80.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.75 -16.03 61.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.899 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -85.45 -30.3 23.63 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.667 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -116.23 39.12 3.18 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -177.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.38 33.3 81.69 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 117.171 1.629 . . . . 0.0 117.171 175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.439 ' HD2' HD11 ' A' ' 25' ' ' ILE . 75.8 m-85 -126.23 49.34 2.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 118.82 1.31 . . . . 0.0 109.83 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -72.0 -23.31 61.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.714 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -68.12 -53.71 23.36 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.619 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.602 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.2 OUTLIER -58.29 -46.51 85.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.645 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.81 -34.5 76.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.46 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.97 79.29 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.602 HD12 ' HA ' ' A' ' 83' ' ' LEU . 64.7 mt -64.07 -21.82 66.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.658 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.787 HD22 ' HA ' ' A' ' 9' ' ' LEU . 2.8 mt -102.42 -12.22 18.03 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.115 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -59.14 -21.89 60.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.093 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -62.08 -32.79 73.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.994 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 5' ' ' ALA . . . -99.67 -15.27 32.23 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.987 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.522 HG23 HG22 ' A' ' 69' ' ' VAL . 45.9 mm -72.75 112.89 16.98 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 117.049 0.424 . . . . 0.0 110.481 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 91' ' ' ILE . 7.3 Cg_exo -73.71 -72.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 123.016 2.478 . . . . 0.0 112.793 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.01 170.14 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.064 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.9 m -102.88 101.8 12.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.377 0.608 . . . . 0.0 110.631 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 23.1 p -52.41 121.63 7.34 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.33 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 62.0 m -105.01 -168.17 1.44 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.97 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.9 m . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.229 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.6 139.58 44.92 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.821 2.347 . . . . 0.0 112.86 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -88.36 151.29 22.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.74 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -126.51 84.65 0.34 Allowed Glycine 0 C--N 1.32 -0.348 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.712 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 9.5 t -158.04 -156.56 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.357 0.598 . . . . 0.0 110.585 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.779 ' HB3' ' HD3' ' A' ' 6' ' ' ARG . 29.6 ttm -101.62 177.63 4.86 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.373 -178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 5' ' ' ALA . 49.0 t0 -87.7 135.03 33.54 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.93 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.54 -49.61 76.78 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 123.49 0.494 . . . . 0.0 110.665 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -58.75 -45.15 90.35 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.867 0.365 . . . . 0.0 110.292 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.923 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -62.5 -54.81 34.39 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.683 0.754 . . . . 0.0 111.22 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.779 ' HD3' ' HB3' ' A' ' 1' ' ' MET . 8.0 ttp180 -64.0 -25.95 68.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.831 -178.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 54.6 m-20 -84.51 -50.9 7.31 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.648 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 84.4 m -54.92 -22.61 15.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.57 0.7 . . . . 0.0 110.219 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.942 ' HA ' HD11 ' A' ' 87' ' ' LEU . 2.6 tp -76.42 -59.15 2.89 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.473 179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.906 ' HA ' HD13 ' A' ' 16' ' ' LEU . 5.4 mt -83.37 -27.58 29.56 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -177.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -60.94 -33.01 72.5 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.963 0.411 . . . . 0.0 109.975 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -86.19 40.56 0.88 Allowed 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.784 178.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.802 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.27 -22.77 32.14 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 179.087 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -56.14 -25.3 45.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.93 177.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.74 -16.85 7.58 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.118 178.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.919 ' HG ' HD12 ' A' ' 20' ' ' ILE . 0.7 OUTLIER -56.19 -87.71 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.109 179.544 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -57.44 -22.37 42.92 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.187 0.517 . . . . 0.0 111.647 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.94 -50.78 38.62 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -108.91 -31.89 7.49 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.919 HD12 ' HG ' ' A' ' 16' ' ' LEU . 6.0 mt -58.4 117.33 1.66 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.255 0.55 . . . . 0.0 110.854 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -109.88 166.76 10.67 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.479 ' HA ' HD22 ' A' ' 56' ' ' LEU . 2.8 t -121.6 -22.76 5.77 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -176.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -56.56 -78.18 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -64.55 -47.24 79.48 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.63 HD13 HD23 ' A' ' 75' ' ' LEU . 58.4 mt -52.82 -46.08 51.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -178.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.744 ' O ' HG13 ' A' ' 30' ' ' ILE . 36.3 ttp -72.47 -28.33 62.84 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.273 178.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -65.1 -34.74 79.12 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.76 0.791 . . . . 0.0 109.076 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.464 ' CD2' ' HB3' ' A' ' 77' ' ' HIS . 88.6 m-70 -74.32 -31.41 62.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.751 178.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.4 ' HE3' ' N ' ' A' ' 71' ' ' PHE . 55.3 mtp -74.35 -36.69 63.63 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 26' ' ' MET . 15.5 mt -74.03 -42.25 52.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.6 m -67.68 -25.23 65.59 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 28' ' ' HIS . 28.7 t70 -73.73 -24.27 59.88 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.33 1.63 62.41 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.654 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD2' ' HB2' ' A' ' 70' ' ' SER . 4.2 m-85 -84.17 -33.02 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.179 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.96 HD21 ' HE1' ' A' ' 59' ' ' MET . 1.1 mp -96.72 128.48 43.71 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 177.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.3 p -91.69 176.31 6.58 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.38 -38.19 73.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.394 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.1 t -66.26 -34.16 77.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.496 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.603 ' OE1' ' HA ' ' A' ' 35' ' ' LEU . 85.5 mt-10 -75.91 -42.78 47.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.851 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB2' HD13 ' A' ' 30' ' ' ILE . 23.2 tt0 -61.32 -49.09 78.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.911 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 45' ' ' ASN . 42.5 tt0 -51.05 -56.91 10.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.94 -178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 16.8 ttmm -64.36 -46.44 83.41 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.726 HG22 ' HG3' ' A' ' 55' ' ' MET . 68.0 t -58.94 -42.12 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.249 0.547 . . . . 0.0 110.461 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -78.73 -26.55 44.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.831 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.65 -32.97 73.15 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.129 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -62.47 146.68 93.31 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -80.94 -33.05 0.87 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.522 2.148 . . . . 0.0 116.127 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.9 p -133.32 173.04 11.89 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 121.521 -0.737 . . . . 0.0 110.513 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 52' ' ' ARG . 9.2 tt0 -56.03 -20.83 18.36 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.348 0.405 . . . . 0.0 109.927 177.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.512 HE21 ' HB3' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -46.66 -74.11 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.056 178.401 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 88.1 mm-40 -88.0 -12.5 44.26 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.257 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.471 ' HB3' ' HA ' ' A' ' 49' ' ' GLN . 43.7 ttm-85 -72.05 -58.32 3.53 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.576 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.06 -39.34 86.86 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 58' ' ' LYS . . . -63.3 -34.81 78.5 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.146 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.726 ' HG3' HG22 ' A' ' 43' ' ' VAL . 11.1 tpt -68.33 -44.95 74.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 117.857 0.299 . . . . 0.0 110.196 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 22' ' ' THR . 22.6 tp -58.7 -54.08 51.17 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.715 0.769 . . . . 0.0 110.233 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.626 ' HA ' HD12 ' A' ' 60' ' ' ILE . 24.7 mm -68.64 -19.23 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.079 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 29.7 ttpp -80.2 -34.63 37.22 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.96 ' HE1' HD21 ' A' ' 35' ' ' LEU . 15.2 mtm -59.35 -49.3 78.35 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 57' ' ' ILE . 13.7 mt -61.39 -34.54 61.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 114.107 -1.406 . . . . 0.0 111.132 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 10' ' ' LEU . 2.7 tm? -57.04 -25.95 59.49 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.093 0.473 . . . . 0.0 110.481 178.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -138.1 39.68 2.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.221 0.534 . . . . 0.0 110.406 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -106.37 -138.74 0.37 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.74 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.28 164.79 26.92 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 120.815 0.341 . . . . 0.0 110.974 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.577 ' O ' HG23 ' A' ' 69' ' ' VAL . 25.9 t-20 -58.67 -39.76 81.61 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.243 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.29 -52.66 60.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.348 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.498 ' HA ' ' HD2' ' A' ' 34' ' ' PHE . 0.9 OUTLIER -68.89 -28.82 67.04 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.152 0.501 . . . . 0.0 110.472 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.923 ' CE2' ' HB1' ' A' ' 5' ' ' ALA . 35.6 t80 -65.73 -45.12 83.87 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.169 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' ASN . 22.0 t -64.31 -31.28 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.526 ' HB2' ' CD2' ' A' ' 34' ' ' PHE . 46.3 t -70.06 -51.03 35.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.407 ' HE2' HD13 ' A' ' 9' ' ' LEU . 21.2 t80 -54.83 -39.87 69.0 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.628 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 66.2 t80 -58.37 -50.3 74.16 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 177.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -62.67 -31.02 71.83 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.682 -1.145 . . . . 0.0 111.177 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.83 80.13 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.94 0.4 . . . . 0.0 110.216 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.63 HD23 HD13 ' A' ' 25' ' ' ILE . 16.3 mt -65.06 -33.51 76.22 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.9 mp -80.62 -19.58 45.1 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.173 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.464 ' HB3' ' CD2' ' A' ' 28' ' ' HIS . 0.2 OUTLIER -71.8 -25.42 61.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -111.34 -138.05 0.37 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.085 177.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -122.52 52.34 0.76 Allowed Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.889 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.557 ' CD2' HD11 ' A' ' 25' ' ' ILE . 9.8 m-85 -133.73 43.77 2.83 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.556 0.694 . . . . 0.0 110.597 -179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -74.71 -14.87 60.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.598 -0.728 . . . . 0.0 112.114 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -83.25 -32.61 26.36 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.488 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HA ' HD12 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -67.98 -42.3 81.04 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 176.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.628 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -62.86 -32.34 73.55 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.814 -1.539 . . . . 0.0 110.557 177.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -68.6 -27.81 66.37 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 83' ' ' LEU . 44.6 mt -70.46 -16.72 62.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.634 0.731 . . . . 0.0 109.131 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 9' ' ' LEU . 7.0 mp -112.52 2.29 16.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.844 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 85' ' ' ALA . 14.6 t-160 -59.78 -38.23 81.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.836 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -65.24 -30.31 71.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.19 178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 92' ' ' PRO . . . -74.7 -34.22 54.01 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.19 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.701 HD13 ' CE2' ' A' ' 68' ' ' TYR . 18.9 mm -72.74 107.85 3.67 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 90' ' ' GLY . 22.5 Cg_exo -64.48 -62.05 0.1 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.421 2.081 . . . . 0.0 111.717 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 44.1 t -104.57 104.39 16.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 t -79.14 73.62 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.432 0.634 . . . . 0.0 110.86 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 79.5 p -132.0 163.32 28.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.1 m -134.28 44.31 2.71 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.041 0.448 . . . . 0.0 110.38 179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.249 1.062 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.164 -179.851 . . . . . . . . 0 0 . 1 stop_ save_