data_2otk_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 2otk _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.415 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt . . . . . 0 C--O 1.234 0.271 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.494 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . 0.494 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.445 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.467 ' CD1' HD12 ' F' ' 31' ' ' ILE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.445 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . 0.462 ' H ' HE22 ' F' ' 55' ' ' GLN . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.467 HD12 ' CD1' ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . 0.462 HE22 ' H ' ' F' ' 23' ' ' ASN . 24.8 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' C' ' 34' ' ' LEU . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . 0.404 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.452 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.435 HG13 ' CZ ' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.452 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.4 HD11 HG21 ' F' ' 31' ' ' ILE . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.431 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--O 1.235 0.315 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.458 ' SD ' HG12 ' E' ' 16' ' ' ILE . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . 0.446 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . 0.458 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.43 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.431 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.431 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.43 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.415 HD12 HG21 ' F' ' 16' ' ' ILE . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.451 HG23 HD12 ' F' ' 31' ' ' ILE . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 C--O 1.234 0.276 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.496 0.188 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.443 HG23 HD12 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . 0.413 ' CZ ' HD12 ' E' ' 45' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.413 HD12 ' CZ ' ' E' ' 30' ' ' PHE . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm100 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.433 HD13 HG21 ' F' ' 31' ' ' ILE . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.418 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 22.1 m . . . . . 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.335 0.112 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.422 HD13 HG22 ' C' ' 31' ' ' ILE . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.453 HG22 HD12 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.424 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.449 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.418 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.449 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.8 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.424 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.416 HD11 HG22 ' F' ' 16' ' ' ILE . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.447 HG22 HD11 ' F' ' 31' ' ' ILE . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.446 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.9 m . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm . . . . . 0 C--O 1.235 0.334 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.424 ' ND2' HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.426 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.424 HE22 ' ND2' ' E' ' 23' ' ' ASN . 18.8 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.438 HD12 ' CD1' ' E' ' 31' ' ' ILE . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.346 0.117 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.458 HD12 HG22 ' C' ' 31' ' ' ILE . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.436 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.408 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.436 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 mm? . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.1 m . . . . . 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm . . . . . 0 C--O 1.235 0.313 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.452 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.436 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.452 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.426 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 m . . . . . 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 C--O 1.234 0.266 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.413 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.46 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.426 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.46 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.6 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.413 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.4 HD13 HG23 ' F' ' 16' ' ' ILE . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.438 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.428 HD12 HG21 ' F' ' 31' ' ' ILE . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 13.6 m . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.571 0.224 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.517 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.465 ' H ' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.459 HD21 ' CG ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . 0.459 ' CG ' HD21 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.465 HE22 ' H ' ' E' ' 23' ' ' ASN . 18.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.517 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.446 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 C--O 1.235 0.342 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.495 ' SD ' ' CE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.456 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.406 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.414 HD12 HG23 ' F' ' 16' ' ' ILE . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.495 ' CE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 N--CA 1.465 0.281 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.448 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 N--CA 1.464 0.244 0 N-CA-C 110.406 -0.22 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.415 HG22 HD11 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.477 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . 0.477 ' H ' ' ND2' ' E' ' 23' ' ' ASN . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.434 ' CD1' ' HE3' ' E' ' 49' ' ' LYS . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . 0.434 ' HE3' ' CD1' ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.411 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.405 HD13 HG21 ' F' ' 16' ' ' ILE . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.419 HG22 HD13 ' F' ' 31' ' ' ILE . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.3 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . 0.405 ' CG1' HG13 ' C' ' 31' ' ' ILE . 18.1 m . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 120.589 0.233 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.405 HG13 ' CG1' ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.417 HG22 HD11 ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.476 ' CD1' HD11 ' F' ' 31' ' ' ILE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.421 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.55 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.476 HD11 ' CD1' ' E' ' 31' ' ' ILE . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.465 0.278 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.445 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.445 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.419 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.407 HD11 HG22 ' F' ' 16' ' ' ILE . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.429 HD13 ' CD1' ' E' ' 31' ' ' ILE . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.425 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm . . . . . 0 C--O 1.236 0.343 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.547 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.425 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.455 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.547 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.4 HD12 HG23 ' F' ' 16' ' ' ILE . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.41 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.341 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.438 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt . . . . . 0 C--O 1.234 0.248 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.436 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.438 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.433 ' CD1' ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.436 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.445 HD13 HG21 ' F' ' 31' ' ' ILE . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . 0.461 HG22 ' SD ' ' C' ' 35' ' ' MET . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.445 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 18.6 m . . . . . 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.461 0.172 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.41 HG21 HD11 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.461 ' SD ' HG22 ' C' ' 18' ' ' VAL . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.425 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.445 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.425 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.406 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 13.2 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 C--O 1.235 0.317 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.488 ' SD ' HG12 ' E' ' 16' ' ' ILE . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . 0.488 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . 0.451 ' CD2' ' HB2' ' E' ' 52' ' ' ASN . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' HD11 ' F' ' 31' ' ' ILE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.413 ' CD1' ' HE2' ' E' ' 49' ' ' LYS . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . 0.413 ' HE2' ' CD1' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.419 HD13 HG22 ' F' ' 16' ' ' ILE . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.446 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 C--O 1.236 0.344 0 CA-C-O 120.609 0.242 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.416 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.416 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.445 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' F' ' 49' ' ' LYS . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.326 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.441 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' HD13 ' F' ' 31' ' ' ILE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.402 HD13 HG23 ' F' ' 16' ' ' ILE . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . 0.416 HD21 ' HB3' ' F' ' 56' ' ' ALA . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.447 HD13 ' CD1' ' E' ' 31' ' ' ILE . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . 0.416 ' HB3' HD21 ' F' ' 21' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 m . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.452 HG22 HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.412 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.412 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.362 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.432 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt . . . . . 0 C--O 1.233 0.216 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.404 HD13 HG22 ' C' ' 31' ' ' ILE . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.444 ' CD1' HD12 ' F' ' 31' ' ' ILE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . 0.483 HD23 ' CG ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . 0.483 ' CG ' HD23 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.429 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.411 HD12 HG23 ' F' ' 16' ' ' ILE . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' F' ' 19' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.444 HD12 ' CD1' ' E' ' 31' ' ' ILE . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' F' ' 47' ' ' GLU . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mm? . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.42 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . 0.406 ' CG1' HG13 ' C' ' 31' ' ' ILE . 16.5 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . 0.421 ' CG2' ' HB3' ' E' ' 20' ' ' PRO . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 35' ' ' MET . . . . . 0.518 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . 0.421 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . 0.434 HD21 HE22 ' E' ' 55' ' ' GLN . 2.0 m-80 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.433 ' CD1' HD11 ' F' ' 31' ' ' ILE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.458 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . 0.434 HE22 HD21 ' E' ' 23' ' ' ASN . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . 0.431 HD12 HG21 ' F' ' 16' ' ' ILE . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.518 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.433 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 120.954 0.407 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 18.7 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 120.445 0.164 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 32' ' ' ILE . . . . . 0.429 HG22 HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 21' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 48' ' ' ALA . . . . . 0.417 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 51' ' ' LEU . . . . . 0.417 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' E' E ' 56' ' ' ALA . . . . . 0.419 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 18' ' ' TYR . . . . . 0.404 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 31' ' ' ILE . . . . . 0.427 HD12 ' CD1' ' E' ' 31' ' ' ILE . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.2 146.02 50.56 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.415 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.43 -1.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.87 -136.94 41.17 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 9.0 t 53.57 -167.33 0.07 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -82.99 2.91 32.45 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -92.51 -15.45 27.02 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.511 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.494 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . 0.494 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.34 134.96 0.25 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 49.64 -144.17 9.56 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-N 114.404 -0.898 . . . . 0.0 113.307 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 39.5 t -130.57 139.62 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.515 -0.342 . . . . 0.0 110.675 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.761 179.577 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.445 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.467 ' CD1' HD12 ' F' ' 31' ' ' ILE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.445 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . 0.462 ' H ' HE22 ' F' ' 55' ' ' GLN . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.467 HD12 ' CD1' ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . 0.462 HE22 ' H ' ' F' ' 23' ' ' ASN . 24.8 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.08 147.02 49.68 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 113.991 -1.459 . . . . 0.0 108.037 177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' C' ' 34' ' ' LEU . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 m -124.21 -13.24 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.86 -124.08 35.53 Favored Glycine 0 C--N 1.339 0.714 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 49.57 28.22 2.44 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 66.25 5.51 3.7 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.023 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -98.44 -5.06 33.22 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.338 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.81 72.97 0.53 Allowed Glycine 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -143.29 -169.12 12.37 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 p -133.23 143.1 40.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.76 -0.22 . . . . 0.0 110.832 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 89.0 t . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.157 -0.925 . . . . 0.0 109.853 179.359 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . 0.404 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.452 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.435 HG13 ' CZ ' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.452 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.4 HD11 HG21 ' F' ' 31' ' ' ILE . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.43 0.633 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.88 148.09 43.28 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.254 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.431 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 14.8 m -118.39 -6.35 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.45 -124.36 34.61 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.206 -1.558 . . . . 0.0 109.206 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m 48.78 28.39 1.87 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 66.02 5.06 3.31 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.08 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -98.01 -5.84 33.21 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.293 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.458 ' SD ' HG12 ' E' ' 16' ' ' ILE . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . 0.446 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.6 137.74 0.03 OUTLIER Glycine 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.35 -172.81 47.49 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.61 153.26 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 111.468 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 118.17 -0.919 . . . . 0.0 111.046 179.592 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . 0.458 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.43 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.431 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.431 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.43 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.415 HD12 HG21 ' F' ' 16' ' ' ILE . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.451 HG23 HD12 ' F' ' 31' ' ' ILE . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-O 121.112 0.482 . . . . 0.0 111.707 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -114.26 134.61 54.81 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.113 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -112.01 11.03 8.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.8 -46.69 0.43 Allowed Glycine 0 N--CA 1.475 1.248 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 95.5 p -56.72 174.25 0.16 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.955 0.407 . . . . 0.0 111.69 -178.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -53.3 -24.36 11.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.396 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -58.44 -24.97 61.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.74 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.443 HG23 HD12 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.14 128.96 0.02 OUTLIER Glycine 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.88 173.22 11.04 Favored Glycine 0 C--N 1.339 0.72 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 p -127.36 145.18 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.737 -0.231 . . . . 0.0 110.533 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.87 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . 0.413 ' CZ ' HD12 ' E' ' 45' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.413 HD12 ' CZ ' ' E' ' 30' ' ' PHE . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm100 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.433 HD13 HG21 ' F' ' 31' ' ' ILE . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.23 145.5 49.32 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.418 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 22.1 m -115.02 -31.32 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.2 10.77 2.86 Favored Glycine 0 CA--C 1.534 1.268 0 O-C-N 123.329 0.393 . . . . 0.0 113.265 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 31.2 m -87.5 59.5 5.51 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.201 0.5 . . . . 0.0 109.681 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 24.0 m120 61.88 35.97 16.13 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.386 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -145.55 -23.51 0.47 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.288 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.422 HD13 HG22 ' C' ' 31' ' ' ILE . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.453 HG22 HD12 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.07 148.69 12.93 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -42.7 -57.73 3.83 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.061 -0.57 . . . . 0.0 111.782 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 23.4 t -141.6 149.11 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.078 0.465 . . . . 0.0 111.091 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.91 179.293 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.424 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.449 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.418 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.449 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.8 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.424 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.416 HD11 HG22 ' F' ' 16' ' ' ILE . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.447 HG22 HD11 ' F' ' 31' ' ' ILE . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.41 145.44 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.446 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.9 m -114.15 -11.88 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.37 -128.89 39.56 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 22.3 t 52.13 23.51 2.32 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.03 4.44 4.06 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.181 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm -94.43 -5.26 46.7 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.346 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.53 34.76 89.56 Favored Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.33 -169.13 44.07 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-O 121.454 0.475 . . . . 0.0 111.998 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 30.2 m -139.86 116.75 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 114.225 -0.987 . . . . 0.0 109.533 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 C--O 1.221 -0.414 0 CA-C-O 118.312 -0.851 . . . . 0.0 109.778 -179.254 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.424 ' ND2' HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.426 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.426 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.424 HE22 ' ND2' ' E' ' 23' ' ' ASN . 18.8 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.438 HD12 ' CD1' ' E' ' 31' ' ' ILE . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.585 0.707 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.44 150.41 34.78 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.484 -1.234 . . . . 0.0 109.558 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . 0.404 ' C ' ' H ' ' C' ' 26' ' ' SER . 20.1 t -122.1 73.77 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.71 5.8 1.6 Allowed Glycine 0 CA--C 1.535 1.291 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.822 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' SER . . . . . 0.404 ' H ' ' C ' ' C' ' 24' ' ' VAL . 61.5 m -78.96 47.6 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 117.247 0.523 . . . . 0.0 110.538 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 15.3 t30 62.12 37.7 14.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.133 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -142.02 -1.31 1.24 Allowed 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.204 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.458 HD12 HG22 ' C' ' 31' ' ' ILE . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 57.79 63.86 4.89 Favored Glycine 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -130.11 -159.66 9.82 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.2 p -136.47 141.56 40.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.537 -0.331 . . . . 0.0 110.556 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.845 179.516 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.436 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.408 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.436 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.404 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -85.35 145.21 27.61 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.1 m -123.46 -13.01 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.04 -124.89 38.12 Favored Glycine 0 C--N 1.339 0.744 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.5 m 49.36 28.3 2.28 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 13.7 t30 68.7 0.64 2.73 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.18 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -94.38 -5.64 45.98 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.433 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.94 105.77 2.46 Favored Glycine 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.64 -155.41 8.26 Favored Glycine 0 C--N 1.341 0.819 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 6.8 p -140.66 149.78 21.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.271 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.914 179.733 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.452 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.436 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.452 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -119.36 148.06 43.63 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.994 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.426 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.69 -5.63 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.47 -120.04 16.51 Favored Glycine 0 C--N 1.34 0.785 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.5 p 40.19 34.86 0.23 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.96 1.8 1.24 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.074 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -96.02 -5.89 40.05 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.361 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 52.86 58.29 11.96 Favored Glycine 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -136.15 -168.42 11.49 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.7 p -136.87 143.71 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.607 -0.296 . . . . 0.0 110.656 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.597 179.591 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.413 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.46 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.426 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.46 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.6 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.413 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.4 HD13 HG23 ' F' ' 16' ' ' ILE . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.438 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.428 HD12 HG21 ' F' ' 31' ' ' ILE . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.773 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -112.89 128.32 56.43 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.215 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 13.6 m -123.59 -12.5 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.59 -122.6 30.5 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 -178.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m 48.47 28.79 1.82 Allowed 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 25.0 t30 68.36 1.63 2.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.927 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -97.06 -6.53 34.99 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.401 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.517 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 48.12 75.4 0.19 Allowed Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -144.7 -150.66 5.27 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.4 p -134.04 143.78 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.462 -0.369 . . . . 0.0 110.421 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.236 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.4 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.465 ' H ' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.459 HD21 ' CG ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . 0.459 ' CG ' HD21 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.465 HE22 ' H ' ' E' ' 23' ' ' ASN . 18.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.517 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt . . . . . 0 C--O 1.236 0.357 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -109.39 129.49 55.53 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.446 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.9 m -122.26 -5.13 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.94 -117.51 7.54 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 16.8 p 38.0 35.73 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.68 2.1 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.181 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -97.39 -6.09 34.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.338 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.495 ' SD ' ' CE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.86 33.97 75.87 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -91.67 -173.58 42.83 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-O 121.778 0.654 . . . . 0.0 112.657 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 20.5 m -137.27 139.4 43.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 113.869 -1.165 . . . . 0.0 109.15 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.222 -0.374 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.051 -179.507 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.456 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.456 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.406 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.414 HD12 HG23 ' F' ' 16' ' ' ILE . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.495 ' CE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 121.199 0.523 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -108.79 133.77 52.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.033 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.448 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 m -119.97 -14.5 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.0 -125.32 39.02 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 -178.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.2 m 51.21 27.5 3.53 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.65 6.89 4.75 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.747 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -99.57 -6.35 27.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.406 178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.415 HG22 HD11 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.46 136.7 0.01 OUTLIER Glycine 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.75 -172.61 55.17 Favored Glycine 0 N--CA 1.468 0.812 0 CA-C-N 114.978 -0.611 . . . . 0.0 112.571 178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 t -128.93 142.41 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.393 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.946 179.632 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.477 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . 0.477 ' H ' ' ND2' ' E' ' 23' ' ' ASN . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.448 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.434 ' CD1' ' HE3' ' E' ' 49' ' ' LYS . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . 0.434 ' HE3' ' CD1' ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.411 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.405 HD13 HG21 ' F' ' 16' ' ' ILE . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.419 HG22 HD13 ' F' ' 31' ' ' ILE . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 121.201 0.524 . . . . 0.0 111.681 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.18 146.22 49.6 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.874 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . 0.405 ' CG1' HG13 ' C' ' 31' ' ' ILE . 18.1 m -116.82 2.0 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.97 -46.04 0.73 Allowed Glycine 0 CA--C 1.533 1.159 0 O-C-N 123.189 0.306 . . . . 0.0 113.082 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 36.1 m -56.83 167.78 0.73 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 111.481 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -52.98 -24.54 9.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.751 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -56.74 -28.55 61.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.1 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.405 HG13 ' CG1' ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.417 HG22 HD11 ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.57 143.14 0.03 OUTLIER Glycine 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.57 178.37 7.58 Favored Glycine 0 N--CA 1.467 0.76 0 CA-C-N 114.947 -0.627 . . . . 0.0 112.508 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.33 136.81 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.159 -0.521 . . . . 0.0 109.868 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 p . . . . . 0 CA--C 1.537 0.477 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.774 179.579 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.476 ' CD1' HD11 ' F' ' 31' ' ' ILE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.421 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.55 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.476 HD11 ' CD1' ' E' ' 31' ' ' ILE . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.452 0.168 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.97 134.32 44.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.961 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.445 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 m -117.27 -11.35 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.45 -122.43 29.83 Favored Glycine 0 C--N 1.34 0.757 0 N-CA-C 109.032 -1.627 . . . . 0.0 109.032 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 26' ' ' SER . . . . . 0.41 ' C ' ' H ' ' C' ' 28' ' ' LYS . 4.3 m 47.07 28.5 0.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 69.94 -5.38 1.27 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.156 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' C' ' 26' ' ' SER . 31.8 mtmm -89.77 -4.48 57.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.307 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.99 133.23 0.31 Allowed Glycine 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 60.75 -172.15 6.66 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.77 146.86 24.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.227 -0.486 . . . . 0.0 111.02 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 90.0 t . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.41 179.544 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.445 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.419 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.407 HD11 HG22 ' F' ' 16' ' ' ILE . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.429 HD13 ' CD1' ' E' ' 31' ' ' ILE . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.38 148.39 24.24 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.321 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.425 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 10.0 m -122.42 -17.08 5.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.21 -126.12 33.1 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 23.0 t 50.34 26.6 2.33 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 65.76 6.96 4.21 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.673 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -97.65 -4.33 37.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.079 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.14 122.11 2.92 Favored Glycine 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.4 -158.25 5.88 Favored Glycine 0 C--N 1.346 1.132 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -140.33 144.31 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.655 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.718 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.547 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.425 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.455 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.547 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.4 HD12 HG23 ' F' ' 16' ' ' ILE . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.41 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.42 146.65 49.99 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.858 178.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.438 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 15.5 m -123.47 -10.93 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 -122.12 28.52 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.4 m 48.2 28.22 1.5 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 67.05 2.08 2.59 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.826 -178.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -95.76 -7.3 37.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.215 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.15 136.14 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.12 176.57 41.42 Favored Glycine 0 N--CA 1.464 0.526 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.4 p -130.68 145.39 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.453 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.324 -179.967 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.436 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.438 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.433 ' CD1' ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.406 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . 0.433 ' HE2' ' CD1' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.436 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.445 HD13 HG21 ' F' ' 31' ' ' ILE . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . 0.401 ' NZ ' HG23 ' C' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.43 141.81 34.65 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.087 0.242 . . . . 0.0 110.411 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . 0.461 HG22 ' SD ' ' C' ' 35' ' ' MET . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.445 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 18.6 m -133.54 117.24 26.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -82.97 15.74 31.05 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.318 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.4 t -79.3 43.49 0.54 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.681 0.277 . . . . 0.0 111.059 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.79 36.56 16.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 0.0 110.31 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -138.5 -21.72 1.02 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.988 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.41 HG21 HD11 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.461 ' SD ' HG22 ' C' ' 18' ' ' VAL . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.79 108.91 0.74 Allowed Glycine 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.76 -176.99 5.28 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.1 148.05 33.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.35 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.894 179.881 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.425 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.445 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.425 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.406 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . 0.43 ' H ' ' HA2' ' C' ' 37' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 0.0 110.847 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -108.45 130.77 55.24 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.305 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.436 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 13.2 m -117.17 -10.44 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 -124.57 36.96 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m 49.06 27.87 1.87 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 19.6 m120 67.21 3.05 3.04 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.141 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -96.74 -5.03 39.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.278 178.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.488 ' SD ' HG12 ' E' ' 16' ' ' ILE . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . 0.43 ' HA2' ' H ' ' C' ' 16' ' ' LYS . . . 67.9 137.22 0.06 OUTLIER Glycine 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.91 -171.35 54.45 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.38 -0.41 . . . . 0.0 112.345 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 36.4 t -132.91 154.86 40.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 115.26 -0.47 . . . . 0.0 110.816 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.162 179.399 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . 0.488 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . 0.451 ' CD2' ' HB2' ' E' ' 52' ' ' ASN . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.446 ' CD1' HD11 ' F' ' 31' ' ' ILE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.413 ' CD1' ' HE2' ' E' ' 49' ' ' LYS . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.43 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . 0.413 ' HE2' ' CD1' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.419 HD13 HG22 ' F' ' 16' ' ' ILE . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.446 HD11 ' CD1' ' E' ' 31' ' ' ILE . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -118.19 142.49 47.39 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 114.264 -1.335 . . . . 0.0 108.444 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.45 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.5 m -122.85 -10.83 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.79 -125.53 39.96 Favored Glycine 0 C--N 1.34 0.751 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.1 m 50.51 26.23 2.3 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 67.49 4.22 3.7 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.729 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -97.05 -5.6 37.21 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.386 178.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.64 116.88 0.09 OUTLIER Glycine 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.24 -179.55 35.77 Favored Glycine 0 C--N 1.336 0.583 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -127.64 145.95 34.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.14 -179.952 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.416 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.45 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.416 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.445 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . 0.402 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' F' ' 49' ' ' LYS . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.0 146.42 29.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.92 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.441 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 9.9 m -122.42 -14.66 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.09 -124.59 37.16 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 -178.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 50.43 27.14 2.64 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 67.57 4.26 3.76 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.829 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -98.02 -3.61 37.79 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.169 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.469 ' SD ' ' HA2' ' C' ' 38' ' ' GLY . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.63 32.55 84.59 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . 0.469 ' HA2' ' SD ' ' C' ' 35' ' ' MET . . . -71.66 79.85 0.56 Allowed Glycine 0 N--CA 1.443 -0.9 0 CA-C-N 113.688 -1.256 . . . . 0.0 110.644 -178.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 5.9 p -53.6 113.86 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 O-C-N 123.937 0.433 . . . . 0.0 110.128 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.512 -178.995 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' HD13 ' F' ' 31' ' ' ILE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.402 HD13 HG23 ' F' ' 16' ' ' ILE . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . 0.416 HD21 ' HB3' ' F' ' 56' ' ' ALA . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.447 HD13 ' CD1' ' E' ' 31' ' ' ILE . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . 0.416 ' HB3' HD21 ' F' ' 21' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.284 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -111.39 145.92 38.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 m -122.41 -11.41 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -125.28 39.04 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.011 -1.636 . . . . 0.0 109.011 -178.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m 49.42 28.82 2.55 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 178.245 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.31 4.23 3.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.15 -178.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -97.03 -5.86 36.65 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.383 178.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.452 HG22 HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.41 141.35 1.14 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.17 -175.14 5.55 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -136.17 145.11 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.238 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.831 179.849 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.412 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.412 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . 0.421 ' HD2' ' C ' ' C' ' 16' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.73 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -108.05 149.13 28.82 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.29 178.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.432 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 11.3 m -118.7 -1.72 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -138.81 41.76 Favored Glycine 0 C--N 1.338 0.646 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -178.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 8.9 t 54.18 -169.83 0.06 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.92 0.391 . . . . 0.0 112.036 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -79.31 -0.06 30.93 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt -89.38 -15.74 32.59 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.284 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.404 HD13 HG22 ' C' ' 31' ' ' ILE . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.99 155.77 31.67 Favored Glycine 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -23.08 -76.34 0.01 OUTLIER Glycine 0 N--CA 1.48 1.633 0 C-N-CA 124.517 1.056 . . . . 0.0 113.774 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 p -140.81 147.53 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 117.905 -1.045 . . . . 0.0 111.06 -179.777 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.444 ' CD1' HD12 ' F' ' 31' ' ' ILE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . 0.483 HD23 ' CG ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . 0.483 ' CG ' HD23 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.429 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.411 HD12 HG23 ' F' ' 16' ' ' ILE . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' F' ' 19' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.444 HD12 ' CD1' ' E' ' 31' ' ' ILE . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' F' ' 47' ' ' GLU . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . 0.463 ' HZ3' ' N ' ' C' ' 38' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 120.486 0.184 . . . . 0.0 111.236 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -100.4 132.34 45.83 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.044 178.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.42 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . 0.406 ' CG1' HG13 ' C' ' 31' ' ' ILE . 16.5 m -115.07 3.6 7.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.01 -45.82 0.73 Allowed Glycine 0 CA--C 1.532 1.11 0 O-C-N 123.268 0.355 . . . . 0.0 113.065 178.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 15.5 m -56.34 166.49 0.84 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.939 0.399 . . . . 0.0 111.292 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -53.39 -24.34 12.08 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.931 179.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -55.1 -27.97 49.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.422 179.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . 0.421 ' CG2' ' HB3' ' E' ' 20' ' ' PRO . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 35' ' ' MET . . . . . 0.518 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 56.29 32.87 60.83 Favored Glycine 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . 0.463 ' N ' ' HZ3' ' C' ' 16' ' ' LYS . . . -89.6 -170.77 44.72 Favored Glycine 0 C--N 1.331 0.261 0 CA-C-O 121.408 0.449 . . . . 0.0 112.087 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -137.02 133.46 47.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 114.373 -0.913 . . . . 0.0 110.055 -179.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.924 -179.929 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . 0.421 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . 0.434 HD21 HE22 ' E' ' 55' ' ' GLN . 2.0 m-80 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.433 ' CD1' HD11 ' F' ' 31' ' ' ILE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.458 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . 0.434 HE22 HD21 ' E' ' 23' ' ' ASN . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . 0.431 HD12 HG21 ' F' ' 16' ' ' ILE . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.518 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.433 HD11 ' CD1' ' E' ' 31' ' ' ILE . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' C' C ' 16' ' ' LYS . . . . . 0.411 ' HZ2' ' N ' ' C' ' 40' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.821 0.343 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.79 147.06 45.09 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.577 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 19' ' ' PHE . . . . . 0.447 ' CE2' ' CD1' ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 24' ' ' VAL . . . . . . . . . . . . . 18.7 m -120.52 32.63 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 17.52 68.42 0.01 OUTLIER Glycine 0 N--CA 1.483 1.833 0 C-N-CA 124.529 1.062 . . . . 0.0 114.298 178.049 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 72.1 p -163.47 179.37 7.33 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -55.85 -25.57 42.7 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.421 0.629 . . . . 0.0 109.885 178.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -63.08 -27.89 69.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.058 178.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 31' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 32' ' ' ILE . . . . . 0.429 HG22 HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 53.91 41.95 68.84 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.7 -164.11 36.71 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.193 -0.504 . . . . 0.0 112.555 -178.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.27 125.43 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 114.797 -0.701 . . . . 0.0 110.319 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 40' ' ' VAL . . . . . 0.411 ' N ' ' HZ2' ' C' ' 16' ' ' LYS . 78.0 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.629 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 21' ' ' ASN . . . . . 0.419 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 31' ' ' ILE . . . . . 0.447 ' CD1' ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 45' ' ' LEU . . . . . . . . . . . . . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 48' ' ' ALA . . . . . 0.417 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 51' ' ' LEU . . . . . 0.417 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' E' E ' 56' ' ' ALA . . . . . 0.419 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 18' ' ' TYR . . . . . 0.404 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 31' ' ' ILE . . . . . 0.427 HD12 ' CD1' ' E' ' 31' ' ' ILE . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.572 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.797 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.52 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.3 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt . . . . . 0 C--O 1.234 0.271 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.52 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.606 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.512 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 36' ' ' VAL . . . . . 0.512 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' E' ' 23' ' ' ASN . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 26' ' ' GLN . . . . . 0.565 ' OE1' HD13 ' E' ' 51' ' ' LEU . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.562 ' CE1' ' HB2' ' E' ' 48' ' ' ALA . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.797 HD11 ' CE2' ' C' ' 19' ' ' PHE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.572 HD21 HD22 ' C' ' 17' ' ' LEU . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.528 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.562 ' HB2' ' CE1' ' E' ' 30' ' ' PHE . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.494 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.565 HD13 ' OE1' ' E' ' 26' ' ' GLN . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.455 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.673 HD12 HD13 ' F' ' 22' ' ' LEU . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.673 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.41 HD21 ' HB2' ' F' ' 25' ' ' ASP . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 25' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' F' ' 23' ' ' ASN . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.634 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.408 HD11 HD11 ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 33' ' ' SER . . . . . 0.473 ' OG ' HD13 ' F' ' 44' ' ' LEU . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.634 HD11 ' CE2' ' F' ' 30' ' ' PHE . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.473 HD13 ' OG ' ' F' ' 33' ' ' SER . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' F' ' 54' ' ' ALA . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 54' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.574 HD23 HD23 ' C' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.589 ' CD2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.453 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m . . . . . 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.449 ' HA ' HD13 ' C' ' 32' ' ' ILE . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.718 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.406 ' O ' ' HA ' ' C' ' 17' ' ' LEU . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.555 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.459 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.666 ' CZ ' HD11 ' E' ' 34' ' ' LEU . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.666 HD11 ' CZ ' ' E' ' 30' ' ' PHE . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.593 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.437 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.593 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.561 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' F' ' 27' ' ' LEU . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' F' ' 22' ' ' LEU . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.595 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.595 HD11 ' CE2' ' F' ' 30' ' ' PHE . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' F' ' 51' ' ' LEU . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.538 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 14.8 m . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--O 1.235 0.315 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.563 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.467 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 36' ' ' VAL . . . . . 0.467 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 16' ' ' ILE . . . . . 0.464 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.409 ' HB3' HG23 ' C' ' 31' ' ' ILE . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.437 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.538 HD21 HD22 ' C' ' 17' ' ' LEU . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.464 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.502 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.402 HD12 ' OE1' ' F' ' 55' ' ' GLN . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' F' ' 27' ' ' LEU . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.598 ' HA ' HD12 ' F' ' 34' ' ' LEU . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.661 HD11 ' CE2' ' F' ' 30' ' ' PHE . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.49 ' HA ' HD12 ' F' ' 44' ' ' LEU . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' F' ' 41' ' ' SER . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' F' F ' 55' ' ' GLN . . . . . 0.402 ' OE1' HD12 ' F' ' 22' ' ' LEU . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' E' ' 34' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.234 0.276 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.448 HG21 ' SD ' ' C' ' 35' ' ' MET . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.848 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.457 HG11 HG13 ' C' ' 31' ' ' ILE . 10.5 m . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.496 0.188 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.457 HG13 HG11 ' C' ' 24' ' ' VAL . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.556 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.519 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.473 HG11 HD11 ' E' ' 45' ' ' LEU . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.48 HD13 HD22 ' E' ' 22' ' ' LEU . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.48 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.515 ' CE2' HD22 ' E' ' 34' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.848 HD11 ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' C' ' 17' ' ' LEU . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.561 HD12 ' O ' ' E' ' 45' ' ' LEU . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.427 ' HE2' ' HG ' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' F' ' 34' ' ' LEU . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' F' ' 31' ' ' ILE . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.692 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' C' ' 31' ' ' ILE . 22.1 m . . . . . 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.335 0.112 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 30' ' ' ALA . . . . . 0.57 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.558 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.434 HG21 ' HE2' ' E' ' 49' ' ' LYS . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.473 HD13 HD22 ' E' ' 22' ' ' LEU . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.511 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.473 HD22 HD13 ' E' ' 19' ' ' LEU . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.518 HD21 HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.692 HD21 HD22 ' C' ' 17' ' ' LEU . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.639 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.477 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.639 ' CE ' HD22 ' E' ' 45' ' ' LEU . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.518 HE22 HD21 ' E' ' 23' ' ' ASN . 69.4 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' C' ' 30' ' ' ALA . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.506 ' HB2' HD12 ' F' ' 34' ' ' LEU . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' F' ' 51' ' ' LEU . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' E' ' 41' ' ' SER . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.815 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.424 ' O ' HG13 ' C' ' 24' ' ' VAL . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.44 HG11 HG13 ' C' ' 31' ' ' ILE . 10.9 m . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm . . . . . 0 C--O 1.235 0.334 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 30' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.44 HG13 HG11 ' C' ' 24' ' ' VAL . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.443 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.601 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.538 HG21 HD21 ' E' ' 45' ' ' LEU . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.438 HD13 HD22 ' E' ' 22' ' ' LEU . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.436 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.438 HD22 HD13 ' E' ' 19' ' ' LEU . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.509 HD21 HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.815 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.68 ' HB2' HD13 ' C' ' 17' ' ' LEU . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.538 HD21 HG21 ' E' ' 17' ' ' VAL . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.503 ' HE2' HD21 ' E' ' 45' ' ' LEU . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.509 HE22 HD21 ' E' ' 23' ' ' ASN . 64.1 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 17' ' ' VAL . . . . . 0.408 HG23 HD23 ' F' ' 45' ' ' LEU . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.62 HD12 HD13 ' F' ' 22' ' ' LEU . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.62 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.409 ' ND2' ' H ' ' F' ' 26' ' ' GLN . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.688 ' HG2' HD13 ' F' ' 51' ' ' LEU . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.633 ' CE2' HD11 ' F' ' 34' ' ' LEU . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.633 HD11 ' CE2' ' F' ' 30' ' ' PHE . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 45' ' ' LEU . . . . . 0.408 HD23 HG23 ' F' ' 17' ' ' VAL . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.688 HD13 ' HG2' ' F' ' 26' ' ' GLN . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.555 HD22 HD21 ' E' ' 34' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.857 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.541 HG21 HG13 ' C' ' 31' ' ' ILE . 20.1 t . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.346 0.117 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.541 HG13 HG21 ' C' ' 24' ' ' VAL . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.509 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.857 HD11 ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.555 HD21 HD22 ' C' ' 17' ' ' LEU . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.403 ' HB3' HD13 ' C' ' 17' ' ' LEU . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.528 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.475 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.4 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.451 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.442 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.429 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.41 ' CE1' HD21 ' F' ' 34' ' ' LEU . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' F' ' 30' ' ' PHE . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' F' ' 51' ' ' LEU . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.83 ' HG ' HD21 ' E' ' 34' ' ' LEU . 1.3 mm? . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.41 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.866 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.493 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.1 m . . . . . 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm . . . . . 0 C--O 1.235 0.313 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' E' ' 20' ' ' PRO . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.474 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.436 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.441 HG21 ' HE2' ' E' ' 49' ' ' LYS . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.545 ' HB3' HG23 ' C' ' 31' ' ' ILE . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.499 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.866 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.83 HD21 ' HG ' ' C' ' 17' ' ' LEU . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.47 HD12 ' O ' ' E' ' 45' ' ' LEU . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.523 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 17' ' ' VAL . . . . . 0.401 HG23 HD23 ' F' ' 45' ' ' LEU . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.83 HD12 HD13 ' F' ' 22' ' ' LEU . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.83 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' F' ' 27' ' ' LEU . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.662 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.687 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' F' ' 31' ' ' ILE . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.555 ' HA ' HD12 ' F' ' 44' ' ' LEU . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' F' ' 41' ' ' SER . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 45' ' ' LEU . . . . . 0.401 HD23 HG23 ' F' ' 17' ' ' VAL . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.503 HD23 HD11 ' F' ' 22' ' ' LEU . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.543 HD13 ' OG ' ' E' ' 41' ' ' SER . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.533 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.7 m . . . . . 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 C--O 1.234 0.266 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 30' ' ' ALA . . . . . 0.67 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.533 ' CD1' HG11 ' C' ' 24' ' ' VAL . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.523 HD13 HD22 ' E' ' 22' ' ' LEU . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.506 ' HB3' HG23 ' C' ' 31' ' ' ILE . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.523 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.507 HD21 HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.596 ' CE2' HD22 ' E' ' 34' ' ' LEU . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.813 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.596 HD22 ' CE2' ' E' ' 30' ' ' PHE . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.543 ' OG ' HD13 ' C' ' 17' ' ' LEU . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' E' ' 45' ' ' LEU . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.474 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.507 HE22 HD21 ' E' ' 23' ' ' ASN . 66.8 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.513 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.954 HD12 HD13 ' F' ' 22' ' ' LEU . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.954 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.416 ' HB3' HD21 ' F' ' 22' ' ' LEU . 86.5 mm-40 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' F' ' 27' ' ' LEU . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.67 HD11 ' HB3' ' C' ' 30' ' ' ALA . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.482 ' HB2' HD12 ' F' ' 34' ' ' LEU . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' C' ' 17' ' ' LEU . 4.0 mm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.839 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.404 ' OE2' HD12 ' C' ' 31' ' ' ILE . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.542 HG11 HG13 ' C' ' 31' ' ' ILE . 13.6 m . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.571 0.224 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.542 HG13 HG11 ' C' ' 24' ' ' VAL . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.471 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.572 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.483 HG21 HD11 ' E' ' 45' ' ' LEU . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.722 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 0.8 OUTLIER -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 26' ' ' GLN . . . . . 0.722 ' H ' ' ND2' ' E' ' 23' ' ' ASN . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.785 ' CE2' HD11 ' E' ' 34' ' ' LEU . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.839 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.402 ' HB2' HD23 ' C' ' 17' ' ' LEU . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.609 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.609 ' CE ' HD22 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.519 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 51.3 t30 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.519 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.563 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.422 HD11 HD11 ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.563 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.5 mm? . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.891 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.403 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.516 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m . . . . . 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 C--O 1.235 0.342 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.516 ' CD1' HG11 ' C' ' 24' ' ' VAL . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.53 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.505 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.4 HG11 HD21 ' E' ' 45' ' ' LEU . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.514 HD13 HD22 ' E' ' 22' ' ' LEU . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.462 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.514 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.502 ' CE2' HD22 ' E' ' 34' ' ' LEU . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.891 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.545 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.635 HD22 ' HG3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.635 ' HG3' HD22 ' E' ' 45' ' ' LEU . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.505 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.602 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.602 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' F' ' 27' ' ' LEU . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' F' ' 34' ' ' LEU . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.596 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' F' ' 30' ' ' PHE . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.406 ' HA ' HD12 ' F' ' 44' ' ' LEU . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' F' ' 41' ' ' SER . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.433 ' HB2' ' CD1' ' F' ' 22' ' ' LEU . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 4.1 mm? . . . . . 0 N--CA 1.465 0.281 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.827 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.49 HG11 HG13 ' C' ' 31' ' ' ILE . 4.5 m . . . . . 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 N--CA 1.464 0.244 0 N-CA-C 110.406 -0.22 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.49 HG13 HG11 ' C' ' 24' ' ' VAL . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.461 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.634 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.677 HG21 HD21 ' E' ' 45' ' ' LEU . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.538 HD13 HD12 ' E' ' 22' ' ' LEU . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.668 HD22 ' HG2' ' E' ' 26' ' ' GLN . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 26' ' ' GLN . . . . . 0.668 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 27' ' ' LEU . . . . . 0.473 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.511 ' CE2' HD22 ' E' ' 34' ' ' LEU . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.827 HD11 ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' E' ' 30' ' ' PHE . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.677 HD21 HG21 ' E' ' 17' ' ' VAL . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.583 ' HE3' HD11 ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.553 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.553 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.4 HD22 HD13 ' F' ' 22' ' ' LEU . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.4 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.476 ' HG2' HD23 ' F' ' 51' ' ' LEU . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.582 ' CE2' HD11 ' F' ' 34' ' ' LEU . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' F' ' 26' ' ' GLN . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.534 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.3 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.481 ' O ' HG13 ' C' ' 24' ' ' VAL . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.634 HG11 ' CG1' ' C' ' 31' ' ' ILE . 18.1 m . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 120.589 0.233 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 29' ' ' GLY . . . . . 0.562 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.634 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.44 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.615 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.49 HD13 HD22 ' E' ' 22' ' ' LEU . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.49 HD22 HD13 ' E' ' 19' ' ' LEU . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.534 HD21 HD22 ' C' ' 17' ' ' LEU . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.499 ' OG ' HD11 ' E' ' 34' ' ' LEU . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.722 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.58 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.722 ' HE3' HD22 ' E' ' 45' ' ' LEU . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.582 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.694 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.694 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.57 ' HG2' HD13 ' F' ' 51' ' ' LEU . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.686 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' F' ' 34' ' ' LEU . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.686 HD11 ' CE2' ' F' ' 30' ' ' PHE . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.467 ' HA ' HD12 ' F' ' 44' ' ' LEU . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' F' ' 41' ' ' SER . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' F' ' 26' ' ' GLN . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 3.7 mm? . . . . . 0 N--CA 1.465 0.278 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.523 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.6 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' E' ' 20' ' ' PRO . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.539 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.555 HG21 HD21 ' E' ' 45' ' ' LEU . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.53 ' HB3' HG23 ' C' ' 31' ' ' ILE . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.433 ' ND2' HE22 ' E' ' 55' ' ' GLN . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.647 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.647 HD22 ' CZ ' ' E' ' 30' ' ' PHE . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.555 HD21 HG21 ' E' ' 17' ' ' VAL . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.425 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.468 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.468 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.433 HE22 ' ND2' ' E' ' 23' ' ' ASN . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.486 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' F' ' 30' ' ' PHE . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.486 HD23 ' HG2' ' F' ' 26' ' ' GLN . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.744 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.83 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.489 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.0 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm . . . . . 0 C--O 1.236 0.343 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.546 HG23 ' HB3' ' E' ' 20' ' ' PRO . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.665 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 36' ' ' VAL . . . . . 0.416 HG21 ' CD1' ' E' ' 45' ' ' LEU . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.546 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.572 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.474 ' N ' HD12 ' E' ' 22' ' ' LEU . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 27' ' ' LEU . . . . . 0.45 HD21 ' HB2' ' E' ' 22' ' ' LEU . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.503 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.83 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.744 HD21 HD22 ' C' ' 17' ' ' LEU . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.546 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.546 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.572 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.487 HD22 HD13 ' F' ' 22' ' ' LEU . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.487 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.698 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.341 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.555 HG11 HG13 ' C' ' 31' ' ' ILE . 15.5 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt . . . . . 0 C--O 1.234 0.248 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' E' ' 20' ' ' PRO . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.61 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.658 HG21 HD21 ' E' ' 45' ' ' LEU . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.588 ' HB3' HG23 ' C' ' 31' ' ' ILE . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.44 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.541 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.698 HD21 HD22 ' C' ' 17' ' ' LEU . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.68 HD11 ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.68 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.419 HD22 HD13 ' F' ' 22' ' ' LEU . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.419 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 33' ' ' SER . . . . . 0.48 ' OG ' HD13 ' F' ' 44' ' ' LEU . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.48 HD13 ' OG ' ' F' ' 33' ' ' SER . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.503 HD13 ' O ' ' C' ' 35' ' ' MET . 2.4 mm? . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.812 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.598 HG21 ' CG1' ' C' ' 31' ' ' ILE . 18.6 m . . . . . 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.461 0.172 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 30' ' ' ALA . . . . . 0.473 ' HA ' HG22 ' C' ' 24' ' ' VAL . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.598 ' CG1' HG21 ' C' ' 24' ' ' VAL . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.464 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.598 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.503 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.485 ' HB3' HD22 ' E' ' 22' ' ' LEU . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.458 ' HB3' HG23 ' C' ' 31' ' ' ILE . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' E' ' 19' ' ' LEU . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.812 HD11 ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.47 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.408 ' HB2' HD23 ' C' ' 17' ' ' LEU . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.681 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.681 ' HE3' HD22 ' E' ' 45' ' ' LEU . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.407 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.863 HD12 HD13 ' F' ' 22' ' ' LEU . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.863 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.492 ' HG2' HD23 ' F' ' 51' ' ' LEU . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.727 ' CE2' HD11 ' F' ' 34' ' ' LEU . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.663 ' HA ' HD12 ' F' ' 34' ' ' LEU . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.727 HD11 ' CE2' ' F' ' 30' ' ' PHE . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.404 ' HA ' HD12 ' F' ' 44' ' ' LEU . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' F' ' 41' ' ' SER . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.492 HD23 ' HG2' ' F' ' 26' ' ' GLN . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.629 HD13 ' O ' ' C' ' 35' ' ' MET . 4.3 mm? . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.841 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 13.2 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 C--O 1.235 0.317 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.524 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.629 ' O ' HD13 ' C' ' 17' ' ' LEU . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 36' ' ' VAL . . . . . 0.468 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 16' ' ' ILE . . . . . 0.489 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.772 HG21 HD21 ' E' ' 45' ' ' LEU . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.489 HD13 HD12 ' E' ' 22' ' ' LEU . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.467 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.593 HD22 ' HG2' ' E' ' 26' ' ' GLN . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.427 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 26' ' ' GLN . . . . . 0.593 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 27' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.402 ' CE2' HD22 ' E' ' 34' ' ' LEU . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.841 HD11 ' CE2' ' C' ' 19' ' ' PHE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.475 HD11 ' HG ' ' C' ' 17' ' ' LEU . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.497 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.772 HD21 HG21 ' E' ' 17' ' ' VAL . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.479 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.427 HE22 ' ND2' ' E' ' 23' ' ' ASN . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.432 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' F' ' 27' ' ' LEU . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.6 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.409 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.6 HD11 ' CE2' ' F' ' 30' ' ' PHE . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.618 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.9 mm? . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 18' ' ' VAL . . . . . 0.424 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.835 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.5 m . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 C--O 1.236 0.344 0 CA-C-O 120.609 0.242 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.442 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.732 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.585 ' O ' HD13 ' C' ' 17' ' ' LEU . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 36' ' ' VAL . . . . . 0.4 HG22 HD11 ' C' ' 17' ' ' LEU . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.557 HG21 HD21 ' E' ' 45' ' ' LEU . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 23' ' ' ASN . . . . . 0.45 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.587 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.835 HD11 ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.618 HD11 ' HG ' ' C' ' 17' ' ' LEU . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 43' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' E' ' 47' ' ' GLU . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.557 HD21 HG21 ' E' ' 17' ' ' VAL . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 47' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' E' ' 43' ' ' ASN . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.488 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 55' ' ' GLN . . . . . 0.45 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.886 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.886 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.533 ' HG2' HD23 ' F' ' 51' ' ' LEU . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' F' ' 34' ' ' LEU . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.401 HD11 HD11 ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' F' ' 30' ' ' PHE . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.533 HD23 ' HG2' ' F' ' 26' ' ' GLN . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.482 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.493 HD22 HD13 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.326 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 9.9 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.459 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.531 HG21 HD21 ' E' ' 45' ' ' LEU . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.434 HD13 HD22 ' E' ' 22' ' ' LEU . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.455 ' HB3' HG23 ' C' ' 31' ' ' ILE . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.404 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.434 HD22 HD13 ' E' ' 19' ' ' LEU . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 27' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' F' ' 31' ' ' ILE . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' E' ' 34' ' ' LEU . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.925 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' E' ' 30' ' ' PHE . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.406 ' HB2' HD13 ' C' ' 17' ' ' LEU . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.531 HD21 HG21 ' E' ' 17' ' ' VAL . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.406 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 57.6 t30 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.69 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.69 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' F' ' 27' ' ' LEU . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.476 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' F' ' 51' ' ' LEU . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.507 HD22 HD11 ' E' ' 34' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.423 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.1 m . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 30' ' ' ALA . . . . . 0.459 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.501 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.465 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.476 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.57 HG21 HD21 ' E' ' 45' ' ' LEU . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.465 ' HB3' HD22 ' E' ' 22' ' ' LEU . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.437 ' HB3' HG23 ' C' ' 31' ' ' ILE . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.465 HD22 ' HB3' ' E' ' 19' ' ' LEU . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.507 HD11 HD22 ' C' ' 17' ' ' LEU . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 41' ' ' SER . . . . . 0.421 ' HB2' HD13 ' C' ' 17' ' ' LEU . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.57 HD21 HG21 ' E' ' 17' ' ' VAL . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.472 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.478 ' HE2' HD11 ' E' ' 45' ' ' LEU . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.407 ' CG ' HD21 ' F' ' 22' ' ' LEU . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' F' ' 41' ' ' SER . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.524 ' HB2' HD12 ' F' ' 34' ' ' LEU . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' F' ' 22' ' ' LEU . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.612 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.362 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.85 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.3 m . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt . . . . . 0 C--O 1.233 0.216 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.533 HG23 ' HB3' ' E' ' 20' ' ' PRO . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.547 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.402 HG11 HD21 ' E' ' 45' ' ' LEU . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 19' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 22' ' ' LEU . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.533 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 22' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 19' ' ' LEU . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.85 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.612 HD21 HD22 ' C' ' 17' ' ' LEU . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.707 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.707 ' CE ' HD22 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.54 HD21 HD23 ' F' ' 51' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' F' F ' 23' ' ' ASN . . . . . 0.427 ' H ' HD13 ' F' ' 22' ' ' LEU . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.569 ' HG2' HD21 ' F' ' 51' ' ' LEU . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.682 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' F' ' 34' ' ' LEU . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 33' ' ' SER . . . . . 0.435 ' OG ' HD13 ' F' ' 44' ' ' LEU . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.682 HD11 ' CE2' ' F' ' 30' ' ' PHE . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.423 ' HA ' HD12 ' F' ' 44' ' ' LEU . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.435 HD13 ' OG ' ' F' ' 33' ' ' SER . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.569 HD21 ' HG2' ' F' ' 26' ' ' GLN . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' C' C ' 17' ' ' LEU . . . . . 0.563 ' HG ' HD21 ' E' ' 34' ' ' LEU . 2.1 mm? . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.824 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 22' ' ' GLU . . . . . 0.494 ' O ' HG13 ' C' ' 24' ' ' VAL . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.621 HG11 ' CG1' ' C' ' 31' ' ' ILE . 16.5 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' C' C ' 29' ' ' GLY . . . . . 0.592 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.621 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.689 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.824 HD11 ' CE2' ' C' ' 19' ' ' PHE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.563 HD21 ' HG ' ' C' ' 17' ' ' LEU . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.47 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.51 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 49' ' ' LYS . . . . . 0.461 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 53' ' ' ASP . . . . . 0.505 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.505 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' F' ' 26' ' ' GLN . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.534 ' HB3' HD21 ' F' ' 22' ' ' LEU . 31.0 mm-40 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 27' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' F' ' 27' ' ' LEU . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.571 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' F' ' 51' ' ' LEU . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 120.954 0.407 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 19' ' ' PHE . . . . . 0.895 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 24' ' ' VAL . . . . . 0.442 HG11 HG13 ' C' ' 31' ' ' ILE . 18.7 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 120.445 0.164 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 31' ' ' ILE . . . . . 0.521 HG23 ' HB3' ' E' ' 20' ' ' PRO . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.543 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 17' ' ' VAL . . . . . 0.514 HG21 HD21 ' E' ' 45' ' ' LEU . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 20' ' ' PRO . . . . . 0.521 ' HB3' HG23 ' C' ' 31' ' ' ILE . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 21' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' E' ' 34' ' ' LEU . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 31' ' ' ILE . . . . . 0.895 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 45' ' ' LEU . . . . . 0.514 HD21 HG21 ' E' ' 17' ' ' VAL . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 51' ' ' LEU . . . . . 0.489 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' E' E ' 52' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 54' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' E' E ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 18' ' ' TYR . . . . . 0.44 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 19' ' ' LEU . . . . . 0.925 HD12 HD13 ' F' ' 22' ' ' LEU . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 22' ' ' LEU . . . . . 0.925 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 26' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 31' ' ' ILE . . . . . 0.474 ' HA ' HD12 ' F' ' 34' ' ' LEU . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 41' ' ' SER . . . . . 0.446 ' HA ' HD12 ' F' ' 44' ' ' LEU . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 44' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' F' ' 41' ' ' SER . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 51' ' ' LEU . . . . . 0.464 HD23 ' HG2' ' F' ' 26' ' ' GLN . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.572 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER -127.2 146.02 50.56 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.817 178.465 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.797 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.52 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.3 m -121.43 -1.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.87 -136.94 41.17 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 9.0 t 53.57 -167.33 0.07 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -82.99 2.91 32.45 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -92.51 -15.45 27.02 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.511 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.52 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.606 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.512 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 36' ' ' VAL . . . . . 0.512 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.34 134.96 0.25 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 49.64 -144.17 9.56 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-N 114.404 -0.898 . . . . 0.0 113.307 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 39.5 t -130.57 139.62 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.515 -0.342 . . . . 0.0 110.675 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' VAL . . . . . 0.401 ' H ' ' HE3' ' C' ' 35' ' ' MET . 13.2 p . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.761 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' E' ' 23' ' ' ASN . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 26' ' ' GLN . . . . . 0.565 ' OE1' HD13 ' E' ' 51' ' ' LEU . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.562 ' CE1' ' HB2' ' E' ' 48' ' ' ALA . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.797 HD11 ' CE2' ' C' ' 19' ' ' PHE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.572 HD21 HD22 ' C' ' 17' ' ' LEU . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.528 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.562 ' HB2' ' CE1' ' E' ' 30' ' ' PHE . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.494 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.565 HD13 ' OE1' ' E' ' 26' ' ' GLN . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.455 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.673 HD12 HD13 ' F' ' 22' ' ' LEU . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.673 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.41 HD21 ' HB2' ' F' ' 25' ' ' ASP . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 25' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' F' ' 23' ' ' ASN . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.634 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.408 HD11 HD11 ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 33' ' ' SER . . . . . 0.473 ' OG ' HD13 ' F' ' 44' ' ' LEU . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.634 HD11 ' CE2' ' F' ' 30' ' ' PHE . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.473 HD13 ' OG ' ' F' ' 33' ' ' SER . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' F' ' 54' ' ' ALA . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 54' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 16' ' ' LYS . . . . . 0.407 ' HZ1' ' HA ' ' C' ' 39' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.574 HD23 HD23 ' C' ' 34' ' ' LEU . 0.2 OUTLIER -126.08 147.02 49.68 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 113.991 -1.459 . . . . 0.0 108.037 177.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.589 ' CD2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.453 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m -124.21 -13.24 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.86 -124.08 35.53 Favored Glycine 0 C--N 1.339 0.714 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 49.57 28.22 2.44 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 66.25 5.51 3.7 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.023 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -98.44 -5.06 33.22 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.338 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.449 ' HA ' HD13 ' C' ' 32' ' ' ILE . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.718 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.406 ' O ' ' HA ' ' C' ' 17' ' ' LEU . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.81 72.97 0.53 Allowed Glycine 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -143.29 -169.12 12.37 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 39' ' ' VAL . . . . . 0.407 ' HA ' ' HZ1' ' C' ' 16' ' ' LYS . 14.8 p -133.23 143.1 40.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.76 -0.22 . . . . 0.0 110.832 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 89.0 t . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.157 -0.925 . . . . 0.0 109.853 179.359 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.555 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.459 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.666 ' CZ ' HD11 ' E' ' 34' ' ' LEU . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.666 HD11 ' CZ ' ' E' ' 30' ' ' PHE . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.593 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.437 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.593 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.561 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' F' ' 27' ' ' LEU . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' F' ' 22' ' ' LEU . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.595 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.595 HD11 ' CE2' ' F' ' 30' ' ' PHE . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' F' ' 51' ' ' LEU . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.43 0.633 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.538 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER -118.88 148.09 43.28 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.254 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 14.8 m -118.39 -6.35 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.45 -124.36 34.61 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.206 -1.558 . . . . 0.0 109.206 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m 48.78 28.39 1.87 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 66.02 5.06 3.31 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.08 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -98.01 -5.84 33.21 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.293 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.563 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.467 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 36' ' ' VAL . . . . . 0.467 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.6 137.74 0.03 OUTLIER Glycine 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.35 -172.81 47.49 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.61 153.26 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 111.468 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 118.17 -0.919 . . . . 0.0 111.046 179.592 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 16' ' ' ILE . . . . . 0.464 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.409 ' HB3' HG23 ' C' ' 31' ' ' ILE . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.437 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.538 HD21 HD22 ' C' ' 17' ' ' LEU . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.464 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.502 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.402 HD12 ' OE1' ' F' ' 55' ' ' GLN . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' F' ' 27' ' ' LEU . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.598 ' HA ' HD12 ' F' ' 34' ' ' LEU . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.661 HD11 ' CE2' ' F' ' 30' ' ' PHE . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.49 ' HA ' HD12 ' F' ' 44' ' ' LEU . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' F' ' 41' ' ' SER . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' F' F ' 55' ' ' GLN . . . . . 0.402 ' OE1' HD12 ' F' ' 22' ' ' LEU . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-O 121.112 0.482 . . . . 0.0 111.707 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' E' ' 34' ' ' LEU . 4.2 mm? -114.26 134.61 54.81 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.113 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.448 HG21 ' SD ' ' C' ' 35' ' ' MET . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.848 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.457 HG11 HG13 ' C' ' 31' ' ' ILE . 10.5 m -112.01 11.03 8.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.8 -46.69 0.43 Allowed Glycine 0 N--CA 1.475 1.248 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 95.5 p -56.72 174.25 0.16 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.955 0.407 . . . . 0.0 111.69 -178.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -53.3 -24.36 11.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.396 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -58.44 -24.97 61.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.74 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.457 HG13 HG11 ' C' ' 24' ' ' VAL . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.556 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.519 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.14 128.96 0.02 OUTLIER Glycine 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.88 173.22 11.04 Favored Glycine 0 C--N 1.339 0.72 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 p -127.36 145.18 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.737 -0.231 . . . . 0.0 110.533 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.87 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.473 HG11 HD11 ' E' ' 45' ' ' LEU . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.48 HD13 HD22 ' E' ' 22' ' ' LEU . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.48 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.515 ' CE2' HD22 ' E' ' 34' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.848 HD11 ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' C' ' 17' ' ' LEU . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.561 HD12 ' O ' ' E' ' 45' ' ' LEU . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.427 ' HE2' ' HG ' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' F' ' 34' ' ' LEU . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' F' ' 31' ' ' ILE . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.692 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER -124.23 145.5 49.32 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' C' ' 31' ' ' ILE . 22.1 m -115.02 -31.32 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.2 10.77 2.86 Favored Glycine 0 CA--C 1.534 1.268 0 O-C-N 123.329 0.393 . . . . 0.0 113.265 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 31.2 m -87.5 59.5 5.51 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.201 0.5 . . . . 0.0 109.681 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 24.0 m120 61.88 35.97 16.13 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.386 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -145.55 -23.51 0.47 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.288 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 30' ' ' ALA . . . . . 0.57 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.558 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.07 148.69 12.93 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -42.7 -57.73 3.83 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.061 -0.57 . . . . 0.0 111.782 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 23.4 t -141.6 149.11 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.078 0.465 . . . . 0.0 111.091 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.91 179.293 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.434 HG21 ' HE2' ' E' ' 49' ' ' LYS . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.473 HD13 HD22 ' E' ' 22' ' ' LEU . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.511 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.473 HD22 HD13 ' E' ' 19' ' ' LEU . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.518 HD21 HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.692 HD21 HD22 ' C' ' 17' ' ' LEU . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.639 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.477 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.639 ' CE ' HD22 ' E' ' 45' ' ' LEU . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.518 HE22 HD21 ' E' ' 23' ' ' ASN . 69.4 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' C' ' 30' ' ' ALA . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.506 ' HB2' HD12 ' F' ' 34' ' ' LEU . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' F' ' 51' ' ' LEU . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' E' ' 41' ' ' SER . 0.9 OUTLIER -109.41 145.44 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.815 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.424 ' O ' HG13 ' C' ' 24' ' ' VAL . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.44 HG11 HG13 ' C' ' 31' ' ' ILE . 10.9 m -114.15 -11.88 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.37 -128.89 39.56 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 22.3 t 52.13 23.51 2.32 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.03 4.44 4.06 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.181 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm -94.43 -5.26 46.7 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.346 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 30' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.44 HG13 HG11 ' C' ' 24' ' ' VAL . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.443 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.601 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.53 34.76 89.56 Favored Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.33 -169.13 44.07 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-O 121.454 0.475 . . . . 0.0 111.998 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' C' ' 39' ' ' VAL . 30.2 m -139.86 116.75 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 114.225 -0.987 . . . . 0.0 109.533 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 C--O 1.221 -0.414 0 CA-C-O 118.312 -0.851 . . . . 0.0 109.778 -179.254 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.538 HG21 HD21 ' E' ' 45' ' ' LEU . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.438 HD13 HD22 ' E' ' 22' ' ' LEU . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.436 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.438 HD22 HD13 ' E' ' 19' ' ' LEU . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.509 HD21 HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.815 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.68 ' HB2' HD13 ' C' ' 17' ' ' LEU . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.538 HD21 HG21 ' E' ' 17' ' ' VAL . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.503 ' HE2' HD21 ' E' ' 45' ' ' LEU . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.509 HE22 HD21 ' E' ' 23' ' ' ASN . 64.1 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 17' ' ' VAL . . . . . 0.408 HG23 HD23 ' F' ' 45' ' ' LEU . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.62 HD12 HD13 ' F' ' 22' ' ' LEU . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.62 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.409 ' ND2' ' H ' ' F' ' 26' ' ' GLN . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.688 ' HG2' HD13 ' F' ' 51' ' ' LEU . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.633 ' CE2' HD11 ' F' ' 34' ' ' LEU . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.633 HD11 ' CE2' ' F' ' 30' ' ' PHE . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 45' ' ' LEU . . . . . 0.408 HD23 HG23 ' F' ' 17' ' ' VAL . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.688 HD13 ' HG2' ' F' ' 26' ' ' GLN . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.585 0.707 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.555 HD22 HD21 ' E' ' 34' ' ' LEU . 0.4 OUTLIER -114.44 150.41 34.78 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.484 -1.234 . . . . 0.0 109.558 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.857 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.541 HG21 HG13 ' C' ' 31' ' ' ILE . 20.1 t -122.1 73.77 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.71 5.8 1.6 Allowed Glycine 0 CA--C 1.535 1.291 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.822 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 61.5 m -78.96 47.6 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 117.247 0.523 . . . . 0.0 110.538 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 15.3 t30 62.12 37.7 14.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.133 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -142.02 -1.31 1.24 Allowed 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.204 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.541 HG13 HG21 ' C' ' 24' ' ' VAL . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 57.79 63.86 4.89 Favored Glycine 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -130.11 -159.66 9.82 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.2 p -136.47 141.56 40.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.537 -0.331 . . . . 0.0 110.556 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.845 179.516 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.509 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.857 HD11 ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.555 HD21 HD22 ' C' ' 17' ' ' LEU . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.403 ' HB3' HD13 ' C' ' 17' ' ' LEU . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.528 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.475 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.4 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.451 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.442 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.429 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.41 ' CE1' HD21 ' F' ' 34' ' ' LEU . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' F' ' 30' ' ' PHE . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' F' ' 51' ' ' LEU . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.83 ' HG ' HD21 ' E' ' 34' ' ' LEU . 1.3 mm? -85.35 145.21 27.61 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.41 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.866 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.493 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.1 m -123.46 -13.01 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.04 -124.89 38.12 Favored Glycine 0 C--N 1.339 0.744 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.5 m 49.36 28.3 2.28 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 13.7 t30 68.7 0.64 2.73 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.18 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -94.38 -5.64 45.98 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.433 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' E' ' 20' ' ' PRO . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.474 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.436 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.94 105.77 2.46 Favored Glycine 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.64 -155.41 8.26 Favored Glycine 0 C--N 1.341 0.819 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 6.8 p -140.66 149.78 21.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.271 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 40' ' ' VAL . . . . . 0.415 ' H ' ' HE1' ' C' ' 35' ' ' MET . 87.1 t . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.914 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.441 HG21 ' HE2' ' E' ' 49' ' ' LYS . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.545 ' HB3' HG23 ' C' ' 31' ' ' ILE . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.499 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.866 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.83 HD21 ' HG ' ' C' ' 17' ' ' LEU . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.47 HD12 ' O ' ' E' ' 45' ' ' LEU . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.523 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 17' ' ' VAL . . . . . 0.401 HG23 HD23 ' F' ' 45' ' ' LEU . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.83 HD12 HD13 ' F' ' 22' ' ' LEU . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.83 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' F' ' 27' ' ' LEU . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.662 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.687 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' F' ' 31' ' ' ILE . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.555 ' HA ' HD12 ' F' ' 44' ' ' LEU . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' F' ' 41' ' ' SER . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 45' ' ' LEU . . . . . 0.401 HD23 HG23 ' F' ' 17' ' ' VAL . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.503 HD23 HD11 ' F' ' 22' ' ' LEU . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.543 HD13 ' OG ' ' E' ' 41' ' ' SER . 0.7 OUTLIER -119.36 148.06 43.63 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.994 179.357 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.533 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.7 m -122.69 -5.63 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.47 -120.04 16.51 Favored Glycine 0 C--N 1.34 0.785 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.5 p 40.19 34.86 0.23 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.96 1.8 1.24 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.074 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -96.02 -5.89 40.05 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.361 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' ALA . . . . . 0.67 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.533 ' CD1' HG11 ' C' ' 24' ' ' VAL . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 52.86 58.29 11.96 Favored Glycine 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -136.15 -168.42 11.49 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.7 p -136.87 143.71 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.607 -0.296 . . . . 0.0 110.656 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.597 179.591 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.523 HD13 HD22 ' E' ' 22' ' ' LEU . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.506 ' HB3' HG23 ' C' ' 31' ' ' ILE . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.523 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.507 HD21 HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.596 ' CE2' HD22 ' E' ' 34' ' ' LEU . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.813 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.596 HD22 ' CE2' ' E' ' 30' ' ' PHE . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.543 ' OG ' HD13 ' C' ' 17' ' ' LEU . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' E' ' 45' ' ' LEU . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.474 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.507 HE22 HD21 ' E' ' 23' ' ' ASN . 66.8 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.513 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.954 HD12 HD13 ' F' ' 22' ' ' LEU . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.954 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.416 ' HB3' HD21 ' F' ' 22' ' ' LEU . 86.5 mm-40 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' F' ' 27' ' ' LEU . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.67 HD11 ' HB3' ' C' ' 30' ' ' ALA . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.482 ' HB2' HD12 ' F' ' 34' ' ' LEU . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' LYS . . . . . 0.401 ' CD ' HG23 ' C' ' 18' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.773 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' C' ' 17' ' ' LEU . 4.0 mm? -112.89 128.32 56.43 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.215 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.401 HG23 ' CD ' ' C' ' 16' ' ' LYS . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.839 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.404 ' OE2' HD12 ' C' ' 31' ' ' ILE . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.542 HG11 HG13 ' C' ' 31' ' ' ILE . 13.6 m -123.59 -12.5 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.59 -122.6 30.5 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 -178.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m 48.47 28.79 1.82 Allowed 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 25.0 t30 68.36 1.63 2.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.927 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -97.06 -6.53 34.99 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.401 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.542 HG13 HG11 ' C' ' 24' ' ' VAL . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.471 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.572 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 48.12 75.4 0.19 Allowed Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -144.7 -150.66 5.27 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.4 p -134.04 143.78 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.462 -0.369 . . . . 0.0 110.421 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.236 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.483 HG21 HD11 ' E' ' 45' ' ' LEU . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.722 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 0.8 OUTLIER -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 26' ' ' GLN . . . . . 0.722 ' H ' ' ND2' ' E' ' 23' ' ' ASN . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.785 ' CE2' HD11 ' E' ' 34' ' ' LEU . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.839 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.402 ' HB2' HD23 ' C' ' 17' ' ' LEU . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.609 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.609 ' CE ' HD22 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.519 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 51.3 t30 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.519 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 97.7 mm-40 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.563 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.422 HD11 HD11 ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.563 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt . . . . . 0 C--O 1.236 0.357 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.5 mm? -109.39 129.49 55.53 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.891 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.403 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.516 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m -122.26 -5.13 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.94 -117.51 7.54 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 16.8 p 38.0 35.73 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.68 2.1 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.181 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -97.39 -6.09 34.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.338 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.516 ' CD1' HG11 ' C' ' 24' ' ' VAL . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.53 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.505 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.86 33.97 75.87 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -91.67 -173.58 42.83 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-O 121.778 0.654 . . . . 0.0 112.657 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 20.5 m -137.27 139.4 43.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 113.869 -1.165 . . . . 0.0 109.15 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.222 -0.374 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.051 -179.507 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.4 HG11 HD21 ' E' ' 45' ' ' LEU . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.514 HD13 HD22 ' E' ' 22' ' ' LEU . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.462 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.514 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.502 ' CE2' HD22 ' E' ' 34' ' ' LEU . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.891 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.545 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.635 HD22 ' HG3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.635 ' HG3' HD22 ' E' ' 45' ' ' LEU . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.505 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.602 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.602 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' F' ' 27' ' ' LEU . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' F' ' 34' ' ' LEU . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.596 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' F' ' 30' ' ' PHE . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.406 ' HA ' HD12 ' F' ' 44' ' ' LEU . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' F' ' 41' ' ' SER . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.433 ' HB2' ' CD1' ' F' ' 22' ' ' LEU . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 121.199 0.523 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 4.1 mm? -108.79 133.77 52.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.033 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.827 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.49 HG11 HG13 ' C' ' 31' ' ' ILE . 4.5 m -119.97 -14.5 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.0 -125.32 39.02 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 -178.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.2 m 51.21 27.5 3.53 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.65 6.89 4.75 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.747 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -99.57 -6.35 27.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.406 178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.49 HG13 HG11 ' C' ' 24' ' ' VAL . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.461 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.634 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.46 136.7 0.01 OUTLIER Glycine 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.75 -172.61 55.17 Favored Glycine 0 N--CA 1.468 0.812 0 CA-C-N 114.978 -0.611 . . . . 0.0 112.571 178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 t -128.93 142.41 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.393 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.946 179.632 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.677 HG21 HD21 ' E' ' 45' ' ' LEU . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.538 HD13 HD12 ' E' ' 22' ' ' LEU . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.668 HD22 ' HG2' ' E' ' 26' ' ' GLN . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 26' ' ' GLN . . . . . 0.668 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 27' ' ' LEU . . . . . 0.473 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.511 ' CE2' HD22 ' E' ' 34' ' ' LEU . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.827 HD11 ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' E' ' 30' ' ' PHE . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.677 HD21 HG21 ' E' ' 17' ' ' VAL . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.583 ' HE3' HD11 ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.553 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.553 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.4 HD22 HD13 ' F' ' 22' ' ' LEU . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.4 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.476 ' HG2' HD23 ' F' ' 51' ' ' LEU . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.582 ' CE2' HD11 ' F' ' 34' ' ' LEU . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' F' ' 26' ' ' GLN . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 121.201 0.524 . . . . 0.0 111.681 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.534 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -125.18 146.22 49.6 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.874 178.583 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.481 ' O ' HG13 ' C' ' 24' ' ' VAL . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.634 HG11 ' CG1' ' C' ' 31' ' ' ILE . 18.1 m -116.82 2.0 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.97 -46.04 0.73 Allowed Glycine 0 CA--C 1.533 1.159 0 O-C-N 123.189 0.306 . . . . 0.0 113.082 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 36.1 m -56.83 167.78 0.73 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 111.481 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -52.98 -24.54 9.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.751 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -56.74 -28.55 61.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.1 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 29' ' ' GLY . . . . . 0.562 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.634 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.44 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.615 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.57 143.14 0.03 OUTLIER Glycine 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.57 178.37 7.58 Favored Glycine 0 N--CA 1.467 0.76 0 CA-C-N 114.947 -0.627 . . . . 0.0 112.508 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.33 136.81 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.159 -0.521 . . . . 0.0 109.868 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 p . . . . . 0 CA--C 1.537 0.477 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.774 179.579 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.49 HD13 HD22 ' E' ' 22' ' ' LEU . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.49 HD22 HD13 ' E' ' 19' ' ' LEU . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.534 HD21 HD22 ' C' ' 17' ' ' LEU . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.499 ' OG ' HD11 ' E' ' 34' ' ' LEU . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.722 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.58 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.722 ' HE3' HD22 ' E' ' 45' ' ' LEU . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.582 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.694 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.694 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.57 ' HG2' HD13 ' F' ' 51' ' ' LEU . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.686 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' F' ' 34' ' ' LEU . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.686 HD11 ' CE2' ' F' ' 30' ' ' PHE . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.467 ' HA ' HD12 ' F' ' 44' ' ' LEU . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' F' ' 41' ' ' SER . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' F' ' 26' ' ' GLN . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.452 0.168 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 3.7 mm? -100.97 134.32 44.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.961 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.523 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.6 m -117.27 -11.35 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.45 -122.43 29.83 Favored Glycine 0 C--N 1.34 0.757 0 N-CA-C 109.032 -1.627 . . . . 0.0 109.032 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m 47.07 28.5 0.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 69.94 -5.38 1.27 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.156 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -89.77 -4.48 57.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.307 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' E' ' 20' ' ' PRO . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.539 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.99 133.23 0.31 Allowed Glycine 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 60.75 -172.15 6.66 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.77 146.86 24.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.227 -0.486 . . . . 0.0 111.02 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 90.0 t . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.41 179.544 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.555 HG21 HD21 ' E' ' 45' ' ' LEU . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.53 ' HB3' HG23 ' C' ' 31' ' ' ILE . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.433 ' ND2' HE22 ' E' ' 55' ' ' GLN . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 82.1 mm-40 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.647 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.647 HD22 ' CZ ' ' E' ' 30' ' ' PHE . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.555 HD21 HG21 ' E' ' 17' ' ' VAL . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.425 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.468 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.468 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.433 HE22 ' ND2' ' E' ' 23' ' ' ASN . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.486 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' F' ' 30' ' ' PHE . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.486 HD23 ' HG2' ' F' ' 26' ' ' GLN . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.744 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER -99.38 148.39 24.24 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.321 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.83 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.489 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.0 m -122.42 -17.08 5.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.21 -126.12 33.1 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 23.0 t 50.34 26.6 2.33 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 65.76 6.96 4.21 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.673 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -97.65 -4.33 37.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.079 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.546 HG23 ' HB3' ' E' ' 20' ' ' PRO . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.665 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 36' ' ' VAL . . . . . 0.416 HG21 ' CD1' ' E' ' 45' ' ' LEU . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.14 122.11 2.92 Favored Glycine 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.4 -158.25 5.88 Favored Glycine 0 C--N 1.346 1.132 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -140.33 144.31 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.655 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.718 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.546 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.572 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.474 ' N ' HD12 ' E' ' 22' ' ' LEU . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 27' ' ' LEU . . . . . 0.45 HD21 ' HB2' ' E' ' 22' ' ' LEU . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.503 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.83 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.744 HD21 HD22 ' C' ' 17' ' ' LEU . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.546 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.546 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.572 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.487 HD22 HD13 ' F' ' 22' ' ' LEU . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.487 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.698 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -126.42 146.65 49.99 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.858 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.555 HG11 HG13 ' C' ' 31' ' ' ILE . 15.5 m -123.47 -10.93 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 -122.12 28.52 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.4 m 48.2 28.22 1.5 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 67.05 2.08 2.59 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.826 -178.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -95.76 -7.3 37.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.215 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' E' ' 20' ' ' PRO . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.61 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.15 136.14 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.12 176.57 41.42 Favored Glycine 0 N--CA 1.464 0.526 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.4 p -130.68 145.39 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.453 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.324 -179.967 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.658 HG21 HD21 ' E' ' 45' ' ' LEU . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.588 ' HB3' HG23 ' C' ' 31' ' ' ILE . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.44 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.541 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.698 HD21 HD22 ' C' ' 17' ' ' LEU . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.68 HD11 ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.68 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.419 HD22 HD13 ' F' ' 22' ' ' LEU . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.419 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 33' ' ' SER . . . . . 0.48 ' OG ' HD13 ' F' ' 44' ' ' LEU . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.48 HD13 ' OG ' ' F' ' 33' ' ' SER . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 16' ' ' LYS . . . . . 0.459 ' NZ ' HG23 ' C' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.503 HD13 ' O ' ' C' ' 35' ' ' MET . 2.4 mm? -102.43 141.81 34.65 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.087 0.242 . . . . 0.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.459 HG23 ' NZ ' ' C' ' 16' ' ' LYS . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.812 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.598 HG21 ' CG1' ' C' ' 31' ' ' ILE . 18.6 m -133.54 117.24 26.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -82.97 15.74 31.05 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.318 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.4 t -79.3 43.49 0.54 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.681 0.277 . . . . 0.0 111.059 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.79 36.56 16.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 0.0 110.31 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -138.5 -21.72 1.02 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.988 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 30' ' ' ALA . . . . . 0.473 ' HA ' HG22 ' C' ' 24' ' ' VAL . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.598 ' CG1' HG21 ' C' ' 24' ' ' VAL . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.464 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.598 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.503 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.79 108.91 0.74 Allowed Glycine 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.76 -176.99 5.28 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.1 148.05 33.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.35 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 40' ' ' VAL . . . . . 0.408 ' H ' ' HE1' ' C' ' 35' ' ' MET . 14.4 p . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.894 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.485 ' HB3' HD22 ' E' ' 22' ' ' LEU . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.458 ' HB3' HG23 ' C' ' 31' ' ' ILE . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' E' ' 19' ' ' LEU . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.812 HD11 ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.47 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.408 ' HB2' HD23 ' C' ' 17' ' ' LEU . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.681 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.681 ' HE3' HD22 ' E' ' 45' ' ' LEU . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.407 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.863 HD12 HD13 ' F' ' 22' ' ' LEU . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.863 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.492 ' HG2' HD23 ' F' ' 51' ' ' LEU . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.727 ' CE2' HD11 ' F' ' 34' ' ' LEU . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.663 ' HA ' HD12 ' F' ' 34' ' ' LEU . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.727 HD11 ' CE2' ' F' ' 30' ' ' PHE . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.404 ' HA ' HD12 ' F' ' 44' ' ' LEU . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' F' ' 41' ' ' SER . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.492 HD23 ' HG2' ' F' ' 26' ' ' GLN . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.629 HD13 ' O ' ' C' ' 35' ' ' MET . 4.3 mm? -108.45 130.77 55.24 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.305 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.841 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 13.2 m -117.17 -10.44 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 -124.57 36.96 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m 49.06 27.87 1.87 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 19.6 m120 67.21 3.05 3.04 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.141 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -96.74 -5.03 39.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.278 178.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.524 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.629 ' O ' HD13 ' C' ' 17' ' ' LEU . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 36' ' ' VAL . . . . . 0.468 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.9 137.22 0.06 OUTLIER Glycine 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.91 -171.35 54.45 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.38 -0.41 . . . . 0.0 112.345 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 36.4 t -132.91 154.86 40.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 115.26 -0.47 . . . . 0.0 110.816 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.162 179.399 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 16' ' ' ILE . . . . . 0.489 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.772 HG21 HD21 ' E' ' 45' ' ' LEU . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.489 HD13 HD12 ' E' ' 22' ' ' LEU . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.467 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.593 HD22 ' HG2' ' E' ' 26' ' ' GLN . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.427 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 26' ' ' GLN . . . . . 0.593 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 27' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.402 ' CE2' HD22 ' E' ' 34' ' ' LEU . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.841 HD11 ' CE2' ' C' ' 19' ' ' PHE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.475 HD11 ' HG ' ' C' ' 17' ' ' LEU . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.497 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.772 HD21 HG21 ' E' ' 17' ' ' VAL . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.479 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.427 HE22 ' ND2' ' E' ' 23' ' ' ASN . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.432 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' F' ' 27' ' ' LEU . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.6 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.409 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.6 HD11 ' CE2' ' F' ' 30' ' ' PHE . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.618 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.9 mm? -118.19 142.49 47.39 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 114.264 -1.335 . . . . 0.0 108.444 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 18' ' ' VAL . . . . . 0.424 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.835 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.5 m -122.85 -10.83 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.79 -125.53 39.96 Favored Glycine 0 C--N 1.34 0.751 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.1 m 50.51 26.23 2.3 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 67.49 4.22 3.7 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.729 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -97.05 -5.6 37.21 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.386 178.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.442 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.732 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.585 ' O ' HD13 ' C' ' 17' ' ' LEU . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 36' ' ' VAL . . . . . 0.4 HG22 HD11 ' C' ' 17' ' ' LEU . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.64 116.88 0.09 OUTLIER Glycine 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.24 -179.55 35.77 Favored Glycine 0 C--N 1.336 0.583 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -127.64 145.95 34.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.14 -179.952 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.557 HG21 HD21 ' E' ' 45' ' ' LEU . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 23' ' ' ASN . . . . . 0.45 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.587 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.835 HD11 ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.618 HD11 ' HG ' ' C' ' 17' ' ' LEU . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 43' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' E' ' 47' ' ' GLU . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.557 HD21 HG21 ' E' ' 17' ' ' VAL . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 47' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' E' ' 43' ' ' ASN . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.488 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 55' ' ' GLN . . . . . 0.45 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.886 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.886 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.533 ' HG2' HD23 ' F' ' 51' ' ' LEU . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' F' ' 34' ' ' LEU . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.401 HD11 HD11 ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' F' ' 30' ' ' PHE . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.533 HD23 ' HG2' ' F' ' 26' ' ' GLN . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.482 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.493 HD22 HD13 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -105.0 146.42 29.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.92 178.658 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 9.9 m -122.42 -14.66 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.09 -124.59 37.16 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 -178.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 50.43 27.14 2.64 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 67.57 4.26 3.76 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.829 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -98.02 -3.61 37.79 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.169 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.459 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.492 ' SD ' ' HA2' ' C' ' 38' ' ' GLY . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.63 32.55 84.59 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 38' ' ' GLY . . . . . 0.647 ' O ' HG12 ' C' ' 40' ' ' VAL . . . -71.66 79.85 0.56 Allowed Glycine 0 N--CA 1.443 -0.9 0 CA-C-N 113.688 -1.256 . . . . 0.0 110.644 -178.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 39' ' ' VAL . . . . . 0.417 ' O ' HG13 ' C' ' 39' ' ' VAL . 5.9 p -53.6 113.86 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 O-C-N 123.937 0.433 . . . . 0.0 110.128 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 40' ' ' VAL . . . . . 0.647 HG12 ' O ' ' C' ' 38' ' ' GLY . 13.2 p . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.512 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.531 HG21 HD21 ' E' ' 45' ' ' LEU . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.434 HD13 HD22 ' E' ' 22' ' ' LEU . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.455 ' HB3' HG23 ' C' ' 31' ' ' ILE . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.404 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.434 HD22 HD13 ' E' ' 19' ' ' LEU . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 27' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' F' ' 31' ' ' ILE . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' E' ' 34' ' ' LEU . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.925 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' E' ' 30' ' ' PHE . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.406 ' HB2' HD13 ' C' ' 17' ' ' LEU . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.531 HD21 HG21 ' E' ' 17' ' ' VAL . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.406 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 57.6 t30 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.69 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.69 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' F' ' 27' ' ' LEU . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.476 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' F' ' 51' ' ' LEU . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.284 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.507 HD22 HD11 ' E' ' 34' ' ' LEU . 1.0 OUTLIER -111.39 145.92 38.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 179.741 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.423 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.1 m -122.41 -11.41 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -125.28 39.04 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.011 -1.636 . . . . 0.0 109.011 -178.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m 49.42 28.82 2.55 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 178.245 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.31 4.23 3.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.15 -178.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -97.03 -5.86 36.65 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.383 178.519 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 30' ' ' ALA . . . . . 0.459 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.501 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.465 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.476 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.41 141.35 1.14 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.17 -175.14 5.55 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -136.17 145.11 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.238 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.831 179.849 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.57 HG21 HD21 ' E' ' 45' ' ' LEU . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.465 ' HB3' HD22 ' E' ' 22' ' ' LEU . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.437 ' HB3' HG23 ' C' ' 31' ' ' ILE . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.465 HD22 ' HB3' ' E' ' 19' ' ' LEU . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.507 HD11 HD22 ' C' ' 17' ' ' LEU . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.421 ' HB2' HD13 ' C' ' 17' ' ' LEU . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.57 HD21 HG21 ' E' ' 17' ' ' VAL . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.472 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.478 ' HE2' HD11 ' E' ' 45' ' ' LEU . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.407 ' CG ' HD21 ' F' ' 22' ' ' LEU . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' F' ' 41' ' ' SER . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.524 ' HB2' HD12 ' F' ' 34' ' ' LEU . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' F' ' 22' ' ' LEU . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 16' ' ' LYS . . . . . 0.416 ' HD2' ' C ' ' C' ' 16' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.73 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.612 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -108.05 149.13 28.82 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.29 178.079 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.85 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.3 m -118.7 -1.72 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -138.81 41.76 Favored Glycine 0 C--N 1.338 0.646 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -178.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 8.9 t 54.18 -169.83 0.06 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.92 0.391 . . . . 0.0 112.036 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -79.31 -0.06 30.93 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.195 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt -89.38 -15.74 32.59 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.284 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.533 HG23 ' HB3' ' E' ' 20' ' ' PRO . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.547 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.99 155.77 31.67 Favored Glycine 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -23.08 -76.34 0.01 OUTLIER Glycine 0 N--CA 1.48 1.633 0 C-N-CA 124.517 1.056 . . . . 0.0 113.774 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 p -140.81 147.53 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 117.905 -1.045 . . . . 0.0 111.06 -179.777 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.402 HG11 HD21 ' E' ' 45' ' ' LEU . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 22' ' ' LEU . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.533 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 22' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 19' ' ' LEU . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.85 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.612 HD21 HD22 ' C' ' 17' ' ' LEU . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.707 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.707 ' CE ' HD22 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.54 HD21 HD23 ' F' ' 51' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' F' F ' 23' ' ' ASN . . . . . 0.427 ' H ' HD13 ' F' ' 22' ' ' LEU . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.569 ' HG2' HD21 ' F' ' 51' ' ' LEU . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.682 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' F' ' 34' ' ' LEU . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 33' ' ' SER . . . . . 0.435 ' OG ' HD13 ' F' ' 44' ' ' LEU . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.682 HD11 ' CE2' ' F' ' 30' ' ' PHE . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.423 ' HA ' HD12 ' F' ' 44' ' ' LEU . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.435 HD13 ' OG ' ' F' ' 33' ' ' SER . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.569 HD21 ' HG2' ' F' ' 26' ' ' GLN . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' C' C ' 16' ' ' LYS . . . . . 0.46 ' HZ2' ' N ' ' C' ' 38' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 120.486 0.184 . . . . 0.0 111.236 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 17' ' ' LEU . . . . . 0.563 ' HG ' HD21 ' E' ' 34' ' ' LEU . 2.1 mm? -100.4 132.34 45.83 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.044 178.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.824 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 22' ' ' GLU . . . . . 0.494 ' O ' HG13 ' C' ' 24' ' ' VAL . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.621 HG11 ' CG1' ' C' ' 31' ' ' ILE . 16.5 m -115.07 3.6 7.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.01 -45.82 0.73 Allowed Glycine 0 CA--C 1.532 1.11 0 O-C-N 123.268 0.355 . . . . 0.0 113.065 178.164 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 15.5 m -56.34 166.49 0.84 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.939 0.399 . . . . 0.0 111.292 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -53.39 -24.34 12.08 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.931 179.31 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -55.1 -27.97 49.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.422 179.475 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 29' ' ' GLY . . . . . 0.592 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.621 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.689 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 56.29 32.87 60.83 Favored Glycine 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 38' ' ' GLY . . . . . 0.46 ' N ' ' HZ2' ' C' ' 16' ' ' LYS . . . -89.6 -170.77 44.72 Favored Glycine 0 C--N 1.331 0.261 0 CA-C-O 121.408 0.449 . . . . 0.0 112.087 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -137.02 133.46 47.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 114.373 -0.913 . . . . 0.0 110.055 -179.787 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.924 -179.929 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.824 HD11 ' CE2' ' C' ' 19' ' ' PHE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.563 HD21 ' HG ' ' C' ' 17' ' ' LEU . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.47 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.51 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 49' ' ' LYS . . . . . 0.461 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 53' ' ' ASP . . . . . 0.505 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.505 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' F' ' 26' ' ' GLN . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.534 ' HB3' HD21 ' F' ' 22' ' ' LEU . 31.0 mm-40 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 27' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' F' ' 27' ' ' LEU . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.571 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' F' ' 51' ' ' LEU . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.821 0.343 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.79 147.06 45.09 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.577 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 19' ' ' PHE . . . . . 0.895 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 24' ' ' VAL . . . . . 0.442 HG11 HG13 ' C' ' 31' ' ' ILE . 18.7 m -120.52 32.63 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 17.52 68.42 0.01 OUTLIER Glycine 0 N--CA 1.483 1.833 0 C-N-CA 124.529 1.062 . . . . 0.0 114.298 178.049 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 72.1 p -163.47 179.37 7.33 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -55.85 -25.57 42.7 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.421 0.629 . . . . 0.0 109.885 178.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -63.08 -27.89 69.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.058 178.976 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 31' ' ' ILE . . . . . 0.521 HG23 ' HB3' ' E' ' 20' ' ' PRO . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.543 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 35' ' ' MET . . . . . 0.407 ' HE2' ' HA3' ' C' ' 38' ' ' GLY . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 53.91 41.95 68.84 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 38' ' ' GLY . . . . . 0.407 ' HA3' ' HE2' ' C' ' 35' ' ' MET . . . -93.7 -164.11 36.71 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.193 -0.504 . . . . 0.0 112.555 -178.338 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.27 125.43 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 114.797 -0.701 . . . . 0.0 110.319 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.629 179.24 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 17' ' ' VAL . . . . . 0.514 HG21 HD21 ' E' ' 45' ' ' LEU . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 20' ' ' PRO . . . . . 0.521 ' HB3' HG23 ' C' ' 31' ' ' ILE . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 21' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' E' ' 34' ' ' LEU . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 31' ' ' ILE . . . . . 0.895 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 45' ' ' LEU . . . . . 0.514 HD21 HG21 ' E' ' 17' ' ' VAL . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 51' ' ' LEU . . . . . 0.489 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' E' E ' 52' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 54' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' E' E ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 18' ' ' TYR . . . . . 0.44 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 19' ' ' LEU . . . . . 0.925 HD12 HD13 ' F' ' 22' ' ' LEU . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 22' ' ' LEU . . . . . 0.925 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 26' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 31' ' ' ILE . . . . . 0.474 ' HA ' HD12 ' F' ' 34' ' ' LEU . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 41' ' ' SER . . . . . 0.446 ' HA ' HD12 ' F' ' 44' ' ' LEU . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 44' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' F' ' 41' ' ' SER . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 51' ' ' LEU . . . . . 0.464 HD23 ' HG2' ' F' ' 26' ' ' GLN . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.572 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.357 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.797 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.52 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.3 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt . . . . . 0 C--O 1.234 0.271 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.52 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.606 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.512 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . 0.512 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' E' ' 23' ' ' ASN . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.565 ' OE1' HD13 ' E' ' 51' ' ' LEU . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.562 ' CE1' ' HB2' ' E' ' 48' ' ' ALA . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.797 HD11 ' CE2' ' C' ' 19' ' ' PHE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.572 HD21 HD22 ' C' ' 17' ' ' LEU . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.528 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.562 ' HB2' ' CE1' ' E' ' 30' ' ' PHE . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.494 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.565 HD13 ' OE1' ' E' ' 26' ' ' GLN . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.455 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.673 HD12 HD13 ' F' ' 22' ' ' LEU . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.673 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.51 ' H ' HE22 ' F' ' 55' ' ' GLN . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' F' ' 23' ' ' ASN . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.634 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.408 HD11 HD11 ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . 0.473 ' OG ' HD13 ' F' ' 44' ' ' LEU . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.634 HD11 ' CE2' ' F' ' 30' ' ' PHE . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.473 HD13 ' OG ' ' F' ' 33' ' ' SER . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' F' ' 54' ' ' ALA . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . 0.51 HE22 ' H ' ' F' ' 23' ' ' ASN . 24.8 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.574 HD23 HD23 ' C' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.589 ' CD2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.453 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m . . . . . 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 C--O 1.235 0.314 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.449 ' HA ' HD13 ' C' ' 32' ' ' ILE . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.718 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.406 ' O ' ' HA ' ' C' ' 17' ' ' LEU . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.555 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.459 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.666 ' CZ ' HD11 ' E' ' 34' ' ' LEU . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.666 HD11 ' CZ ' ' E' ' 30' ' ' PHE . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.593 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.437 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.593 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.561 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' F' ' 27' ' ' LEU . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' F' ' 22' ' ' LEU . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.595 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.595 HD11 ' CE2' ' F' ' 30' ' ' PHE . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' F' ' 51' ' ' LEU . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.538 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 14.8 m . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--O 1.235 0.315 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.563 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.467 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . 0.467 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . 0.464 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.409 ' HB3' HG23 ' C' ' 31' ' ' ILE . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.437 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.538 HD21 HD22 ' C' ' 17' ' ' LEU . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.464 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.502 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.402 HD12 ' OE1' ' F' ' 55' ' ' GLN . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' F' ' 27' ' ' LEU . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.598 ' HA ' HD12 ' F' ' 34' ' ' LEU . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.661 HD11 ' CE2' ' F' ' 30' ' ' PHE . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.49 ' HA ' HD12 ' F' ' 44' ' ' LEU . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' F' ' 41' ' ' SER . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . 0.402 ' OE1' HD12 ' F' ' 22' ' ' LEU . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' E' ' 34' ' ' LEU . 4.2 mm? . . . . . 0 C--O 1.234 0.276 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.448 HG21 ' SD ' ' C' ' 35' ' ' MET . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.848 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.457 HG11 HG13 ' C' ' 31' ' ' ILE . 10.5 m . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.496 0.188 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.457 HG13 HG11 ' C' ' 24' ' ' VAL . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.556 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.519 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.473 HG11 HD11 ' E' ' 45' ' ' LEU . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.48 HD13 HD22 ' E' ' 22' ' ' LEU . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.48 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.426 ' NE2' HD11 ' E' ' 51' ' ' LEU . 30.1 mm100 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.515 ' CE2' HD22 ' E' ' 34' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.848 HD11 ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' C' ' 17' ' ' LEU . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.561 HD12 ' O ' ' E' ' 45' ' ' LEU . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.427 ' HE2' ' HG ' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm100 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' F' ' 34' ' ' LEU . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' F' ' 31' ' ' ILE . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.692 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' C' ' 31' ' ' ILE . 22.1 m . . . . . 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 120.335 0.112 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . 0.57 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.558 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.434 HG21 ' HE2' ' E' ' 49' ' ' LYS . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.473 HD13 HD22 ' E' ' 22' ' ' LEU . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.511 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.473 HD22 HD13 ' E' ' 19' ' ' LEU . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.487 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.692 HD21 HD22 ' C' ' 17' ' ' LEU . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.639 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.477 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.639 ' CE ' HD22 ' E' ' 45' ' ' LEU . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.487 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.8 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' C' ' 30' ' ' ALA . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.506 ' HB2' HD12 ' F' ' 34' ' ' LEU . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' F' ' 51' ' ' LEU . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' E' ' 41' ' ' SER . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.815 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.424 ' O ' HG13 ' C' ' 24' ' ' VAL . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.44 HG11 HG13 ' C' ' 31' ' ' ILE . 10.9 m . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm . . . . . 0 C--O 1.235 0.334 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.44 HG13 HG11 ' C' ' 24' ' ' VAL . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.443 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.601 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.538 HG21 HD21 ' E' ' 45' ' ' LEU . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.438 HD13 HD22 ' E' ' 22' ' ' LEU . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.436 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.438 HD22 HD13 ' E' ' 19' ' ' LEU . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.455 ' ND2' HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.815 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.68 ' HB2' HD13 ' C' ' 17' ' ' LEU . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.538 HD21 HG21 ' E' ' 17' ' ' VAL . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.503 ' HE2' HD21 ' E' ' 45' ' ' LEU . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.455 HE22 ' ND2' ' E' ' 23' ' ' ASN . 18.8 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . 0.408 HG23 HD23 ' F' ' 45' ' ' LEU . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.62 HD12 HD13 ' F' ' 22' ' ' LEU . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.62 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.409 ' ND2' ' H ' ' F' ' 26' ' ' GLN . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.688 ' HG2' HD13 ' F' ' 51' ' ' LEU . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.633 ' CE2' HD11 ' F' ' 34' ' ' LEU . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.633 HD11 ' CE2' ' F' ' 30' ' ' PHE . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . 0.408 HD23 HG23 ' F' ' 17' ' ' VAL . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.688 HD13 ' HG2' ' F' ' 26' ' ' GLN . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.555 HD22 HD21 ' E' ' 34' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.236 0.392 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.857 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.541 HG21 HG13 ' C' ' 31' ' ' ILE . 20.1 t . . . . . 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.346 0.117 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.541 HG13 HG21 ' C' ' 24' ' ' VAL . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.509 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.857 HD11 ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.555 HD21 HD22 ' C' ' 17' ' ' LEU . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.403 ' HB3' HD13 ' C' ' 17' ' ' LEU . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.528 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.475 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.4 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.451 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.442 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.429 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.41 ' CE1' HD21 ' F' ' 34' ' ' LEU . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' F' ' 30' ' ' PHE . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' F' ' 51' ' ' LEU . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.83 ' HG ' HD21 ' E' ' 34' ' ' LEU . 1.3 mm? . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.41 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.866 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.493 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.1 m . . . . . 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm . . . . . 0 C--O 1.235 0.313 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' E' ' 20' ' ' PRO . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.474 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.436 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.441 HG21 ' HE2' ' E' ' 49' ' ' LYS . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.545 ' HB3' HG23 ' C' ' 31' ' ' ILE . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.499 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.866 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.83 HD21 ' HG ' ' C' ' 17' ' ' LEU . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.47 HD12 ' O ' ' E' ' 45' ' ' LEU . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.523 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . 0.401 HG23 HD23 ' F' ' 45' ' ' LEU . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.83 HD12 HD13 ' F' ' 22' ' ' LEU . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.83 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' F' ' 27' ' ' LEU . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.662 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.687 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' F' ' 31' ' ' ILE . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.555 ' HA ' HD12 ' F' ' 44' ' ' LEU . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' F' ' 41' ' ' SER . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . 0.401 HD23 HG23 ' F' ' 17' ' ' VAL . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.503 HD23 HD11 ' F' ' 22' ' ' LEU . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.543 HD13 ' OG ' ' E' ' 41' ' ' SER . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.533 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.7 m . . . . . 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 C--O 1.234 0.266 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . 0.67 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.533 ' CD1' HG11 ' C' ' 24' ' ' VAL . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.523 HD13 HD22 ' E' ' 22' ' ' LEU . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.506 ' HB3' HG23 ' C' ' 31' ' ' ILE . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.523 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.493 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.596 ' CE2' HD22 ' E' ' 34' ' ' LEU . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.813 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.596 HD22 ' CE2' ' E' ' 30' ' ' PHE . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.543 ' OG ' HD13 ' C' ' 17' ' ' LEU . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' E' ' 45' ' ' LEU . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.474 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.493 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.6 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.513 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.954 HD12 HD13 ' F' ' 22' ' ' LEU . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.954 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.416 ' HB3' HD21 ' F' ' 22' ' ' LEU . 16.7 mm100 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' F' ' 27' ' ' LEU . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.67 HD11 ' HB3' ' C' ' 30' ' ' ALA . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.482 ' HB2' HD12 ' F' ' 34' ' ' LEU . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' C' ' 17' ' ' LEU . 4.0 mm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.839 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.404 ' OE2' HD12 ' C' ' 31' ' ' ILE . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.542 HG11 HG13 ' C' ' 31' ' ' ILE . 13.6 m . . . . . 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.571 0.224 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.542 HG13 HG11 ' C' ' 24' ' ' VAL . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.471 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.572 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.483 HG21 HD11 ' E' ' 45' ' ' LEU . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.512 ' H ' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.785 ' CE2' HD11 ' E' ' 34' ' ' LEU . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.839 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.402 ' HB2' HD23 ' C' ' 17' ' ' LEU . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.609 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.609 ' CE ' HD22 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.519 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.519 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.512 HE22 ' H ' ' E' ' 23' ' ' ASN . 18.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.563 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.422 HD11 HD11 ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.563 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.5 mm? . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.891 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.403 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.516 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m . . . . . 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm . . . . . 0 C--O 1.235 0.342 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.516 ' CD1' HG11 ' C' ' 24' ' ' VAL . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.53 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.505 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.4 HG11 HD21 ' E' ' 45' ' ' LEU . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.514 HD13 HD22 ' E' ' 22' ' ' LEU . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.462 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.514 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.502 ' CE2' HD22 ' E' ' 34' ' ' LEU . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.891 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.545 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.635 HD22 ' HG3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.635 ' HG3' HD22 ' E' ' 45' ' ' LEU . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.505 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.602 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.602 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' F' ' 27' ' ' LEU . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' F' ' 34' ' ' LEU . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.596 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' F' ' 30' ' ' PHE . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.406 ' HA ' HD12 ' F' ' 44' ' ' LEU . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' F' ' 41' ' ' SER . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.433 ' HB2' ' CD1' ' F' ' 22' ' ' LEU . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 4.1 mm? . . . . . 0 N--CA 1.465 0.281 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.827 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.49 HG11 HG13 ' C' ' 31' ' ' ILE . 4.5 m . . . . . 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 N--CA 1.464 0.244 0 N-CA-C 110.406 -0.22 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.49 HG13 HG11 ' C' ' 24' ' ' VAL . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.461 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.634 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.677 HG21 HD21 ' E' ' 45' ' ' LEU . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.538 HD13 HD12 ' E' ' 22' ' ' LEU . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.668 HD22 ' HG2' ' E' ' 26' ' ' GLN . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.668 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . 0.473 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.511 ' CE2' HD22 ' E' ' 34' ' ' LEU . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.827 HD11 ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' E' ' 30' ' ' PHE . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.677 HD21 HG21 ' E' ' 17' ' ' VAL . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.583 ' HE3' HD11 ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.553 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.553 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.4 HD22 HD13 ' F' ' 22' ' ' LEU . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.4 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.476 ' HG2' HD23 ' F' ' 51' ' ' LEU . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.582 ' CE2' HD11 ' F' ' 34' ' ' LEU . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' F' ' 26' ' ' GLN . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.534 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.3 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.481 ' O ' HG13 ' C' ' 24' ' ' VAL . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.634 HG11 ' CG1' ' C' ' 31' ' ' ILE . 18.1 m . . . . . 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 120.589 0.233 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . 0.562 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.634 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.44 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.615 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.49 HD13 HD22 ' E' ' 22' ' ' LEU . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.49 HD22 HD13 ' E' ' 19' ' ' LEU . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.534 HD21 HD22 ' C' ' 17' ' ' LEU . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.499 ' OG ' HD11 ' E' ' 34' ' ' LEU . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.722 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.58 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.722 ' HE3' HD22 ' E' ' 45' ' ' LEU . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.582 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.694 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.694 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.57 ' HG2' HD13 ' F' ' 51' ' ' LEU . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.686 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' F' ' 34' ' ' LEU . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.686 HD11 ' CE2' ' F' ' 30' ' ' PHE . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.467 ' HA ' HD12 ' F' ' 44' ' ' LEU . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' F' ' 41' ' ' SER . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' F' ' 26' ' ' GLN . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 3.7 mm? . . . . . 0 N--CA 1.465 0.278 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.523 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.6 m . . . . . 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' E' ' 20' ' ' PRO . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.539 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.555 HG21 HD21 ' E' ' 45' ' ' LEU . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.53 ' HB3' HG23 ' C' ' 31' ' ' ILE . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.433 ' ND2' HE22 ' E' ' 55' ' ' GLN . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.647 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.647 HD22 ' CZ ' ' E' ' 30' ' ' PHE . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.555 HD21 HG21 ' E' ' 17' ' ' VAL . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.425 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.468 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.468 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.433 HE22 ' ND2' ' E' ' 23' ' ' ASN . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.486 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' F' ' 30' ' ' PHE . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.486 HD23 ' HG2' ' F' ' 26' ' ' GLN . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.744 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.83 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.489 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.0 m . . . . . 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm . . . . . 0 C--O 1.236 0.343 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.546 HG23 ' HB3' ' E' ' 20' ' ' PRO . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.665 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . 0.416 HG21 ' CD1' ' E' ' 45' ' ' LEU . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.546 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.572 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.474 ' N ' HD12 ' E' ' 22' ' ' LEU . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.46 ' NE2' HD11 ' E' ' 51' ' ' LEU . 22.2 mm100 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . 0.45 HD21 ' HB2' ' E' ' 22' ' ' LEU . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.503 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.83 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.744 HD21 HD22 ' C' ' 17' ' ' LEU . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.546 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.546 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.572 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.487 HD22 HD13 ' F' ' 22' ' ' LEU . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.487 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.698 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.341 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.555 HG11 HG13 ' C' ' 31' ' ' ILE . 15.5 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt . . . . . 0 C--O 1.234 0.248 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' E' ' 20' ' ' PRO . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.61 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.658 HG21 HD21 ' E' ' 45' ' ' LEU . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.588 ' HB3' HG23 ' C' ' 31' ' ' ILE . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.44 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.414 ' HA ' ' NE2' ' E' ' 55' ' ' GLN . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.422 ' H ' HE22 ' E' ' 55' ' ' GLN . 29.8 m-80 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.541 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.698 HD21 HD22 ' C' ' 17' ' ' LEU . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.68 HD11 ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.68 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.422 HE22 ' H ' ' E' ' 23' ' ' ASN . 15.4 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.419 HD22 HD13 ' F' ' 22' ' ' LEU . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.419 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . 0.48 ' OG ' HD13 ' F' ' 44' ' ' LEU . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.48 HD13 ' OG ' ' F' ' 33' ' ' SER . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.503 HD13 ' O ' ' C' ' 35' ' ' MET . 2.4 mm? . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.812 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.598 HG21 ' CG1' ' C' ' 31' ' ' ILE . 18.6 m . . . . . 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.461 0.172 . . . . 0.0 110.988 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . 0.473 ' HA ' HG22 ' C' ' 24' ' ' VAL . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.598 ' CG1' HG21 ' C' ' 24' ' ' VAL . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.464 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.598 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.503 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.485 ' HB3' HD22 ' E' ' 22' ' ' LEU . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.458 ' HB3' HG23 ' C' ' 31' ' ' ILE . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' E' ' 19' ' ' LEU . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.418 HD22 ' N ' ' E' ' 23' ' ' ASN . 1.6 m-80 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.812 HD11 ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.47 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.408 ' HB2' HD23 ' C' ' 17' ' ' LEU . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.681 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.681 ' HE3' HD22 ' E' ' 45' ' ' LEU . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.407 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.863 HD12 HD13 ' F' ' 22' ' ' LEU . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.863 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.492 ' HG2' HD23 ' F' ' 51' ' ' LEU . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.727 ' CE2' HD11 ' F' ' 34' ' ' LEU . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.663 ' HA ' HD12 ' F' ' 34' ' ' LEU . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.727 HD11 ' CE2' ' F' ' 30' ' ' PHE . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.404 ' HA ' HD12 ' F' ' 44' ' ' LEU . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' F' ' 41' ' ' SER . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.492 HD23 ' HG2' ' F' ' 26' ' ' GLN . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.629 HD13 ' O ' ' C' ' 35' ' ' MET . 4.3 mm? . . . . . 0 N--CA 1.466 0.375 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.841 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 13.2 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 C--O 1.235 0.317 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.524 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.629 ' O ' HD13 ' C' ' 17' ' ' LEU . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . 0.468 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . 0.489 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.772 HG21 HD21 ' E' ' 45' ' ' LEU . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.489 HD13 HD12 ' E' ' 22' ' ' LEU . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.467 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.593 HD22 ' HG2' ' E' ' 26' ' ' GLN . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.427 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.593 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.402 ' CE2' HD22 ' E' ' 34' ' ' LEU . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.841 HD11 ' CE2' ' C' ' 19' ' ' PHE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.475 HD11 ' HG ' ' C' ' 17' ' ' LEU . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.497 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.772 HD21 HG21 ' E' ' 17' ' ' VAL . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.479 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.427 HE22 ' ND2' ' E' ' 23' ' ' ASN . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.432 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' F' ' 27' ' ' LEU . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.6 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.409 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.6 HD11 ' CE2' ' F' ' 30' ' ' PHE . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.618 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.9 mm? . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . 0.424 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.835 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.5 m . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt . . . . . 0 C--O 1.236 0.344 0 CA-C-O 120.609 0.242 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.442 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.732 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.585 ' O ' HD13 ' C' ' 17' ' ' LEU . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . 0.4 HG22 HD11 ' C' ' 17' ' ' LEU . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.557 HG21 HD21 ' E' ' 45' ' ' LEU . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.45 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.587 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.835 HD11 ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.618 HD11 ' HG ' ' C' ' 17' ' ' LEU . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' E' ' 47' ' ' GLU . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.557 HD21 HG21 ' E' ' 17' ' ' VAL . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' E' ' 43' ' ' ASN . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.488 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.45 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.886 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.886 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.533 ' HG2' HD23 ' F' ' 51' ' ' LEU . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' F' ' 34' ' ' LEU . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.401 HD11 HD11 ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' F' ' 30' ' ' PHE . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.533 HD23 ' HG2' ' F' ' 26' ' ' GLN . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.482 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.493 HD22 HD13 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.326 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 9.9 m . . . . . 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.459 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.531 HG21 HD21 ' E' ' 45' ' ' LEU . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.434 HD13 HD22 ' E' ' 22' ' ' LEU . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.455 ' HB3' HG23 ' C' ' 31' ' ' ILE . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.404 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.434 HD22 HD13 ' E' ' 19' ' ' LEU . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' F' ' 31' ' ' ILE . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' E' ' 34' ' ' LEU . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.925 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' E' ' 30' ' ' PHE . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.406 ' HB2' HD13 ' C' ' 17' ' ' LEU . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.531 HD21 HG21 ' E' ' 17' ' ' VAL . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.406 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 12.0 t-20 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.69 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.69 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' F' ' 27' ' ' LEU . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.476 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' F' ' 51' ' ' LEU . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.507 HD22 HD11 ' E' ' 34' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.423 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.1 m . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.234 0.281 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . 0.459 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.501 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.465 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.476 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.57 HG21 HD21 ' E' ' 45' ' ' LEU . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.465 ' HB3' HD22 ' E' ' 22' ' ' LEU . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.437 ' HB3' HG23 ' C' ' 31' ' ' ILE . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.465 HD22 ' HB3' ' E' ' 19' ' ' LEU . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.426 ' NE2' HD11 ' E' ' 51' ' ' LEU . 29.9 mm100 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.507 HD11 HD22 ' C' ' 17' ' ' LEU . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . 0.421 ' HB2' HD13 ' C' ' 17' ' ' LEU . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.57 HD21 HG21 ' E' ' 17' ' ' VAL . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.472 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.478 ' HE2' HD11 ' E' ' 45' ' ' LEU . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.407 ' CG ' HD21 ' F' ' 22' ' ' LEU . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' F' ' 41' ' ' SER . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.524 ' HB2' HD12 ' F' ' 34' ' ' LEU . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' F' ' 22' ' ' LEU . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.612 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.466 0.362 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.85 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.3 m . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt . . . . . 0 C--O 1.233 0.216 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.533 HG23 ' HB3' ' E' ' 20' ' ' PRO . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.547 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.402 HG11 HD21 ' E' ' 45' ' ' LEU . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 22' ' ' LEU . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.533 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 19' ' ' LEU . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.41 ' NE2' HD11 ' E' ' 51' ' ' LEU . 26.0 mm100 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.85 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.612 HD21 HD22 ' C' ' 17' ' ' LEU . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.707 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.707 ' CE ' HD22 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.54 HD21 HD23 ' F' ' 51' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . 0.427 ' H ' HD13 ' F' ' 22' ' ' LEU . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.569 ' HG2' HD21 ' F' ' 51' ' ' LEU . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.682 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' F' ' 34' ' ' LEU . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . 0.435 ' OG ' HD13 ' F' ' 44' ' ' LEU . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.682 HD11 ' CE2' ' F' ' 30' ' ' PHE . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.423 ' HA ' HD12 ' F' ' 44' ' ' LEU . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.435 HD13 ' OG ' ' F' ' 33' ' ' SER . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.569 HD21 ' HG2' ' F' ' 26' ' ' GLN . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . 0.563 ' HG ' HD21 ' E' ' 34' ' ' LEU . 2.1 mm? . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.824 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . 0.494 ' O ' HG13 ' C' ' 24' ' ' VAL . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.621 HG11 ' CG1' ' C' ' 31' ' ' ILE . 16.5 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.535 0.4 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . 0.592 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.621 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.689 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . 0.498 HD22 HE22 ' E' ' 55' ' ' GLN . 2.0 m-80 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' E' ' 51' ' ' LEU . 29.3 mm100 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.824 HD11 ' CE2' ' C' ' 19' ' ' PHE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.563 HD21 ' HG ' ' C' ' 17' ' ' LEU . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.47 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.51 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . 0.461 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . 0.505 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . 0.498 HE22 HD22 ' E' ' 23' ' ' ASN . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.505 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' F' ' 26' ' ' GLN . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.534 ' HB3' HD21 ' F' ' 22' ' ' LEU . 1.6 mm100 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' F' ' 27' ' ' LEU . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.571 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' F' ' 51' ' ' LEU . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 120.954 0.407 . . . . 0.0 110.577 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 19' ' ' PHE . . . . . 0.895 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 24' ' ' VAL . . . . . 0.442 HG11 HG13 ' C' ' 31' ' ' ILE . 18.7 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 120.445 0.164 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 31' ' ' ILE . . . . . 0.521 HG23 ' HB3' ' E' ' 20' ' ' PRO . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.543 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 17' ' ' VAL . . . . . 0.514 HG21 HD21 ' E' ' 45' ' ' LEU . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 20' ' ' PRO . . . . . 0.521 ' HB3' HG23 ' C' ' 31' ' ' ILE . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 21' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' E' ' 34' ' ' LEU . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 31' ' ' ILE . . . . . 0.895 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 45' ' ' LEU . . . . . 0.514 HD21 HG21 ' E' ' 17' ' ' VAL . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 51' ' ' LEU . . . . . 0.489 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' E' E ' 52' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 54' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' E' E ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 18' ' ' TYR . . . . . 0.44 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 19' ' ' LEU . . . . . 0.925 HD12 HD13 ' F' ' 22' ' ' LEU . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 22' ' ' LEU . . . . . 0.925 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 26' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 31' ' ' ILE . . . . . 0.474 ' HA ' HD12 ' F' ' 34' ' ' LEU . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 41' ' ' SER . . . . . 0.446 ' HA ' HD12 ' F' ' 44' ' ' LEU . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 44' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' F' ' 41' ' ' SER . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 51' ' ' LEU . . . . . 0.464 HD23 ' HG2' ' F' ' 26' ' ' GLN . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-O 121.379 0.609 . . . . 0.0 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.572 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER -127.2 146.02 50.56 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.817 178.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 4.2 t -140.97 135.9 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 O-C-N 123.455 0.472 . . . . 0.0 110.409 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.797 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -99.67 130.62 45.91 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.462 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 42.1 p90 -140.38 155.48 46.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.121 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.66 131.3 56.98 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -101.73 128.94 47.83 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.931 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.63 115.59 16.53 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.52 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.3 m -121.43 -1.45 7.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.627 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.87 -136.94 41.17 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 9.0 t 53.57 -167.33 0.07 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -82.99 2.91 32.45 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -92.51 -15.45 27.02 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.938 -1.028 . . . . 0.0 111.511 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.01 -98.22 0.29 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.91 163.0 23.2 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.52 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.5 mt -114.1 134.14 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.321 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -83.81 117.34 29.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.608 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.63 149.57 20.04 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.62 -1.792 . . . . 0.0 108.62 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.606 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -127.62 151.38 49.01 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.506 0.67 . . . . 0.0 110.813 -179.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.512 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 2.6 tpp -96.42 144.47 26.51 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.218 -1.356 . . . . 0.0 109.009 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.512 ' N ' ' HG3' ' C' ' 35' ' ' MET . 11.3 t -125.44 111.05 26.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 O-C-N 123.861 0.726 . . . . 0.0 112.114 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.34 134.96 0.25 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 115.448 0.939 . . . . 0.0 115.448 175.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 49.64 -144.17 9.56 Favored Glycine 0 N--CA 1.468 0.807 0 CA-C-N 114.404 -0.898 . . . . 0.0 113.307 177.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 39.5 t -130.57 139.62 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.515 -0.342 . . . . 0.0 110.675 -179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . 0.401 ' H ' ' HE3' ' C' ' 35' ' ' MET . 13.2 p . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.761 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.99 0 N-CA-C 112.274 -0.33 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -80.73 124.19 28.83 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.37 129.94 63.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-O 121.632 0.73 . . . . 0.0 111.692 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.2 t -107.84 145.85 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 113.964 -1.471 . . . . 0.0 112.241 -178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -125.81 128.95 48.46 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.205 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.51 61.51 36.57 Favored Pre-proline 0 N--CA 1.473 0.722 0 O-C-N 123.183 0.302 . . . . 0.0 110.963 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.6 Cg_endo -68.66 -25.06 34.57 Favored 'Trans proline' 0 N--CA 1.5 1.889 0 C-N-CA 122.592 2.194 . . . . 0.0 111.501 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.0 m-20 -78.49 -19.27 53.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.609 -178.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.06 132.65 35.25 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.064 0.459 . . . . 0.0 110.915 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' E' ' 23' ' ' ASN . 2.6 p30 -71.97 159.2 86.11 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.89 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.42 -38.57 74.09 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.387 2.058 . . . . 0.0 112.661 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 -63.97 -43.39 95.9 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.565 ' OE1' HD13 ' E' ' 51' ' ' LEU . 0.8 OUTLIER -66.31 -46.3 77.38 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.622 179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.27 -36.88 83.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 36.0 m -66.9 -42.8 84.87 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.97 -46.2 88.85 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.514 0.673 . . . . 0.0 109.71 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.562 ' CE1' ' HB2' ' E' ' 48' ' ' ALA . 80.6 t80 -61.68 -50.89 70.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.644 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.797 HD11 ' CE2' ' C' ' 19' ' ' PHE . 51.2 mt -60.2 -33.98 55.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -72.31 -47.8 47.1 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 15.8 p -64.93 -39.15 93.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.49 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.572 HD21 HD22 ' C' ' 17' ' ' LEU . 47.5 tp -62.38 -42.46 99.43 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.936 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -72.8 -48.43 38.14 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.995 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -60.06 -38.12 81.9 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.1 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -120.98 80.71 34.48 Favored Pre-proline 0 CA--C 1.54 0.561 0 O-C-N 123.245 0.341 . . . . 0.0 110.86 -179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.2 -33.15 31.88 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.208 1.939 . . . . 0.0 111.775 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 t -62.24 -35.69 79.71 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.259 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -93.22 10.82 30.24 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.108 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -53.13 -40.38 64.19 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.22 -48.07 66.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.113 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.409 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.0 m120 -63.18 -46.75 85.67 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.825 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.17 -39.69 83.3 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.484 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.528 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -63.19 -37.39 87.04 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.882 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -54.81 -35.8 64.27 Favored 'General case' 0 N--CA 1.458 -0.033 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -72.53 -37.99 68.15 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.697 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.562 ' HB2' ' CE1' ' E' ' 30' ' ' PHE . . . -69.48 -33.39 72.82 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.494 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.88 -37.0 81.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 176.348 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 54.8 mttt -63.13 -39.83 95.81 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.565 HD13 ' OE1' ' E' ' 26' ' ' GLN . 25.8 mt -65.72 -37.6 86.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -55.43 -37.65 67.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -82.64 -37.3 25.11 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.896 177.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.484 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -70.91 -26.32 63.16 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.338 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -103.68 -1.29 28.32 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.807 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.455 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.992 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.576 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -66.65 145.54 55.47 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.8 mt -117.84 143.84 27.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.375 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.3 120.15 50.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.591 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.462 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 4.2 m-85 -98.63 138.88 35.17 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.427 0.454 . . . . 0.0 110.704 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.673 HD12 HD13 ' F' ' 22' ' ' LEU . 2.6 mm? -116.35 72.56 5.06 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.854 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -79.54 -54.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.746 2.297 . . . . 0.0 113.292 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -84.74 5.84 26.76 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.673 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -74.93 156.12 36.69 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.51 ' H ' HE22 ' F' ' 55' ' ' GLN . 0.0 OUTLIER -86.83 141.91 33.95 Favored Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -53.96 -40.38 81.16 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.337 2.024 . . . . 0.0 113.145 -178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . 0.41 ' HB2' HD21 ' F' ' 23' ' ' ASN . 71.7 m-20 -63.61 -36.12 82.78 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -63.98 -39.54 94.35 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.099 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 5.1 mt -60.81 -44.14 97.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.8 178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -61.42 -46.64 89.29 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.119 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.66 88.2 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.646 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.634 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.1 t80 -62.87 -53.62 51.4 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.284 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.408 HD11 HD11 ' E' ' 31' ' ' ILE . 96.5 mt -58.97 -34.93 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.616 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -62.86 -45.23 93.53 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.538 178.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . 0.473 ' OG ' HD13 ' F' ' 44' ' ' LEU . 48.6 p -65.09 -36.23 83.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.403 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.634 HD11 ' CE2' ' F' ' 30' ' ' PHE . 88.6 mt -60.55 -38.32 84.13 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -76.94 -35.94 56.92 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.423 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -54.44 -39.58 67.53 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -156.19 111.61 2.09 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -53.63 -38.94 84.61 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 122.605 2.203 . . . . 0.0 113.176 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 60.2 p -63.75 -35.67 81.33 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 120.981 -0.287 . . . . 0.0 111.02 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.1 -24.78 63.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 87.0 p -47.03 -42.67 18.76 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.0 78.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.906 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -65.72 -41.71 91.92 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.909 0.385 . . . . 0.0 110.069 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.473 HD13 ' OG ' ' F' ' 33' ' ' SER . 40.7 mt -61.27 -34.32 74.99 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.741 179.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.56 -37.66 84.65 Favored 'General case' 0 CA--C 1.522 -0.101 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.007 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.76 -58.34 7.16 Favored 'General case' 0 N--CA 1.457 -0.108 0 O-C-N 123.489 0.493 . . . . 0.0 109.989 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.87 -44.06 94.37 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.279 0.362 . . . . 0.0 111.047 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.22 -42.94 92.19 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -65.95 -37.62 86.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.532 178.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -63.22 -34.88 78.6 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.197 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' F' ' 54' ' ' ALA . 26.0 mt -61.14 -39.69 91.0 Favored 'General case' 0 CA--C 1.513 -0.48 0 O-C-N 123.136 0.272 . . . . 0.0 110.629 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.37 -36.44 68.83 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.02 -38.35 32.21 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.7 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . 0.412 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -69.81 -32.47 70.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.733 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . 0.51 HE22 ' H ' ' F' ' 23' ' ' ASN . 24.8 mt-30 -99.57 -3.06 34.15 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.69 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.324 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.345 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.407 ' HZ1' ' HA ' ' C' ' 39' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.279 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.574 HD23 HD23 ' C' ' 34' ' ' LEU . 0.2 OUTLIER -126.08 147.02 49.68 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 113.991 -1.459 . . . . 0.0 108.037 177.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.6 t -139.07 128.45 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.148 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.589 ' CD2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -89.23 133.44 34.44 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.489 ' CG ' ' CE1' ' F' ' 18' ' ' TYR . 51.5 p90 -146.48 157.15 43.71 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.206 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.14 132.65 56.0 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.239 178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -104.18 127.93 51.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.85 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.4 117.6 18.23 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.453 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m -124.21 -13.24 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.289 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.86 -124.08 35.53 Favored Glycine 0 C--N 1.339 0.714 0 N-CA-C 108.92 -1.672 . . . . 0.0 108.92 -178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 49.57 28.22 2.44 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 66.25 5.51 3.7 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.023 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -98.44 -5.06 33.22 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.338 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.01 -106.32 1.62 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 108.727 -1.749 . . . . 0.0 108.727 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.82 165.65 18.28 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.737 0.303 . . . . 0.0 110.315 178.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' E' ' 20' ' ' PRO . 22.8 mt -115.24 131.56 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.977 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.449 ' HA ' HD13 ' C' ' 32' ' ' ILE . 0.8 OUTLIER -79.06 130.68 35.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.775 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.8 155.89 26.63 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.718 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -137.17 129.9 30.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 122.032 0.92 . . . . 0.0 111.079 179.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.406 ' O ' ' HA ' ' C' ' 17' ' ' LEU . 5.6 ttm -79.34 146.81 32.7 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.981 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 16.5 t -127.8 118.26 48.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 124.392 1.058 . . . . 0.0 108.859 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 59.81 72.97 0.53 Allowed Glycine 0 C--N 1.34 0.806 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -143.29 -169.12 12.37 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.849 -0.9 . . . . 0.0 110.849 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . 0.407 ' HA ' ' HZ1' ' C' ' 16' ' ' LYS . 14.8 p -133.23 143.1 40.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.76 -0.22 . . . . 0.0 110.832 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 89.0 t . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.157 -0.925 . . . . 0.0 109.853 179.359 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.786 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -74.55 127.49 33.22 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 10.7 mt -113.21 127.71 70.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.492 0.663 . . . . 0.0 110.596 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 147.19 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.918 -177.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -127.87 124.34 37.25 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 77.7 mt -123.22 51.82 4.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.555 ' HB3' HG23 ' C' ' 31' ' ' ILE . 42.4 Cg_endo -70.95 -19.24 30.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.927 1.751 . . . . 0.0 111.123 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.459 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 68.0 m-20 -79.26 -6.88 57.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.178 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.0 mp -95.71 135.3 37.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -66.8 158.95 78.13 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.7 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -53.22 -35.68 74.73 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.011 1.808 . . . . 0.0 111.285 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -65.34 -49.49 69.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.545 178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -62.01 -42.27 98.98 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.99 -49.73 69.13 Favored 'General case' 0 C--N 1.343 0.294 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 98.1 m -59.69 -38.5 81.72 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.28 0.363 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.51 77.59 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.395 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.666 ' CZ ' HD11 ' E' ' 34' ' ' LEU . 54.2 t80 -80.83 -46.12 15.83 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' C' ' 19' ' ' PHE . 0.4 OUTLIER -58.3 -35.63 54.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.625 -178.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -75.02 -34.94 61.96 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 64.4 m -63.87 -44.05 94.26 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.614 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.666 HD11 ' CZ ' ' E' ' 30' ' ' PHE . 80.5 mt -59.95 -39.85 86.99 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.958 0.408 . . . . 0.0 110.327 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -77.9 -26.36 49.07 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.832 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.91 -42.43 98.04 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.125 0.266 . . . . 0.0 110.944 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -162.8 95.83 1.14 Allowed Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.252 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.85 -16.65 26.63 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 122.91 2.407 . . . . 0.0 113.383 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -59.28 -37.22 77.13 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.727 0.298 . . . . 0.0 110.515 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -96.8 13.11 29.73 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.189 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.5 p -50.23 -40.63 48.16 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.38 -48.24 65.25 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -63.56 -44.63 93.57 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.205 0.316 . . . . 0.0 110.216 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 68.5 mt -60.58 -41.26 94.28 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.376 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.593 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -62.59 -39.58 94.19 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.566 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.47 -36.7 64.41 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.286 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -66.25 -41.79 89.45 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.437 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -74.3 -32.82 63.01 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.04 -178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.593 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.92 -41.24 87.41 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 178.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 42.6 mtpt -63.9 -36.45 83.98 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.561 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.3 OUTLIER -65.93 -37.19 85.42 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.273 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.24 -40.07 70.47 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -80.85 -34.51 33.71 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.412 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.63 -29.55 70.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.206 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -117.47 8.09 12.9 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.005 0.431 . . . . 0.0 110.998 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.676 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -69.3 144.61 53.51 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.255 -0.472 . . . . 0.0 109.779 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.48 144.69 23.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.162 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.0 t -131.55 115.15 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.872 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.489 ' CE1' ' CG ' ' C' ' 20' ' ' PHE . 4.3 m-85 -98.96 133.94 42.51 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.81 85.29 49.86 Favored Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.06 -177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -86.52 -58.53 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 123.036 2.491 . . . . 0.0 112.602 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -59.7 -28.07 67.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.917 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.43 HD23 ' HG ' ' F' ' 27' ' ' LEU . 0.3 OUTLIER -54.98 148.88 12.66 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.302 0.376 . . . . 0.0 111.287 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -86.28 153.53 56.57 Favored Pre-proline 0 C--O 1.233 0.212 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.14 -34.02 89.96 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 121.753 1.635 . . . . 0.0 111.12 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -61.82 -42.95 99.65 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -65.73 -37.67 87.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.517 -1.22 . . . . 0.0 109.66 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' F' ' 22' ' ' LEU . 61.2 mt -65.71 -40.7 92.51 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.455 178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -47.67 84.89 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.652 0.263 . . . . 0.0 110.41 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.53 -39.16 93.7 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.417 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.595 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -62.19 -53.13 59.67 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.591 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 77.0 mt -58.55 -38.5 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.078 0.236 . . . . 0.0 110.793 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -61.24 -40.7 95.03 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.587 -0.524 . . . . 0.0 109.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.2 m -65.49 -41.22 93.48 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.834 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.595 HD11 ' CE2' ' F' ' 30' ' ' PHE . 87.3 mt -59.24 -38.27 79.61 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -81.99 -25.28 34.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.415 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.14 -39.57 90.57 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.18 0.3 . . . . 0.0 110.926 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -158.79 116.08 1.68 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.203 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -57.25 -36.74 99.06 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 122.28 1.987 . . . . 0.0 112.996 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 81.1 p -64.66 -36.59 84.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.623 0.249 . . . . 0.0 111.158 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -72.69 -23.08 60.82 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.0 p -47.12 -45.5 22.32 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.49 73.51 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.827 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -63.9 -39.0 93.15 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.76 0.314 . . . . 0.0 110.296 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -63.73 -36.79 85.03 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.728 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.24 -39.93 88.45 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.747 0.654 . . . . 0.0 110.301 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.34 -54.47 36.49 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -67.42 -38.1 84.07 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.311 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.85 86.46 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.4 ttmt -64.05 -36.4 83.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.891 -1.049 . . . . 0.0 109.283 177.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -68.43 -35.22 77.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' F' ' 51' ' ' LEU . 10.7 tp -63.47 -39.08 93.51 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.506 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -41.24 82.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -71.01 -37.06 72.64 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.236 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.68 68.81 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.763 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -95.56 -6.07 41.22 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.91 0.386 . . . . 0.0 110.785 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.967 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.43 0.633 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.538 HD22 HD21 ' E' ' 34' ' ' LEU . 0.2 OUTLIER -118.88 148.09 43.28 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.254 179.026 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 t -141.1 133.71 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.641 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.84 126.3 44.46 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.341 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.5 p90 -137.07 160.8 37.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.49 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.35 133.57 55.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.528 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -106.4 124.75 50.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -76.06 114.17 14.41 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 14.8 m -118.39 -6.35 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.547 -177.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.45 -124.36 34.61 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.206 -1.558 . . . . 0.0 109.206 -178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.1 m 48.78 28.39 1.87 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 66.02 5.06 3.31 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.08 -178.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -98.01 -5.84 33.21 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.293 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.47 -99.35 0.58 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.82 166.09 22.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.673 0.273 . . . . 0.0 110.652 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 47.8 mt -115.37 134.53 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.012 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -83.66 117.24 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 O-C-N 123.681 0.613 . . . . 0.0 109.634 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.55 147.68 19.29 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 108.438 -1.865 . . . . 0.0 108.438 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.563 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.38 155.26 40.63 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.709 0.766 . . . . 0.0 111.126 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.467 ' HG3' ' N ' ' C' ' 36' ' ' VAL . 3.3 tpp -98.25 143.03 29.18 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.965 -1.471 . . . . 0.0 108.68 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.467 ' N ' ' HG3' ' C' ' 35' ' ' MET . 7.9 t -123.55 110.63 26.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 O-C-N 123.888 0.743 . . . . 0.0 110.53 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.6 137.74 0.03 OUTLIER Glycine 0 CA--C 1.527 0.834 0 CA-C-N 115.883 -0.599 . . . . 0.0 113.491 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.35 -172.81 47.49 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.7 p -139.61 153.26 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.89 0.376 . . . . 0.0 111.468 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 118.17 -0.919 . . . . 0.0 111.046 179.592 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.628 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.36 122.17 26.05 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . 0.464 HG12 ' SD ' ' C' ' 35' ' ' MET . 16.8 mt -108.75 125.97 65.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.339 0.59 . . . . 0.0 110.567 -178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 66.7 t -103.78 145.67 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.569 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -126.44 127.23 45.09 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.966 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 15.3 mt -122.04 60.24 11.97 Favored Pre-proline 0 CA--C 1.543 0.7 0 O-C-N 123.18 0.3 . . . . 0.0 110.532 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.409 ' HB3' HG23 ' C' ' 31' ' ' ILE . 46.3 Cg_endo -69.72 -20.39 35.07 Favored 'Trans proline' 0 N--CA 1.5 1.886 0 C-N-CA 122.84 2.36 . . . . 0.0 111.262 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.437 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.2 m-20 -84.52 -4.44 58.95 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.998 -1.001 . . . . 0.0 112.086 -178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -98.13 142.56 29.67 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.879 0.371 . . . . 0.0 110.746 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -87.4 164.76 34.07 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.461 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.69 -32.5 45.52 Favored 'Trans proline' 0 N--CA 1.497 1.707 0 C-N-CA 122.032 1.822 . . . . 0.0 112.264 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -64.32 -46.83 81.8 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -67.62 -47.4 69.76 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.566 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.75 -43.43 96.48 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.398 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 18.8 t -65.03 -43.93 90.77 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.35 94.12 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.418 0.628 . . . . 0.0 109.749 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 61.3 t80 -63.89 -48.3 77.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.473 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 2.0 mt -61.04 -38.42 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.473 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -64.46 -50.12 68.72 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -65.15 -43.52 91.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.262 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.538 HD21 HD22 ' C' ' 17' ' ' LEU . 57.1 tp -56.8 -37.79 71.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.607 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -83.18 -27.06 30.31 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.317 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -62.06 -43.17 99.42 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -136.68 82.47 32.51 Favored Pre-proline 0 N--CA 1.468 0.469 0 O-C-N 123.247 0.342 . . . . 0.0 110.701 -178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.79 -26.37 47.32 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.578 2.185 . . . . 0.0 112.349 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.6 m -60.47 -38.04 82.94 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.818 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -93.19 8.87 38.43 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.314 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -49.9 -33.49 17.45 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.02 -48.84 41.71 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.73 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.464 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 15.0 m120 -63.2 -46.16 88.33 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.091 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.69 -39.67 81.39 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.616 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.11 -37.63 88.15 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.402 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.38 -38.53 63.45 Favored 'General case' 0 C--N 1.335 -0.051 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -68.67 -39.1 80.77 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.587 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.29 -31.89 69.44 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.502 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.16 -40.23 82.41 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 178.128 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -61.24 -37.34 82.71 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -64.5 -39.66 94.21 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.816 177.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 13.6 t-20 -56.33 -40.46 74.47 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.953 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 20.5 t70 -80.34 -28.77 38.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.296 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.68 -30.34 69.84 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.874 -178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -118.3 8.23 12.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.121 0.486 . . . . 0.0 110.756 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.446 -0.646 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.936 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.547 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -93.93 140.61 29.49 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.684 0.278 . . . . 0.0 110.272 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.3 mt -115.14 145.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.2 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 3.8 t -131.15 116.05 31.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.305 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.64 134.0 36.4 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.392 0.433 . . . . 0.0 110.113 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -122.8 78.5 49.09 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.96 -178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -85.62 -58.14 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.993 2.462 . . . . 0.0 112.092 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.3 -26.41 66.5 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.879 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.402 HD12 ' OE1' ' F' ' 55' ' ' GLN . 0.4 OUTLIER -53.6 152.61 4.95 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.201 0.313 . . . . 0.0 111.728 -178.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -87.75 150.42 48.17 Favored Pre-proline 0 C--O 1.234 0.248 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -58.7 -34.9 99.22 Favored 'Trans proline' 0 N--CA 1.493 1.462 0 C-N-CA 121.494 1.463 . . . . 0.0 110.91 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -59.08 -43.77 91.82 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -66.68 -35.85 81.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.377 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' F' ' 27' ' ' LEU . 26.0 mt -63.45 -44.92 93.12 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 121.016 -0.274 . . . . 0.0 110.614 179.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.45 -46.99 88.07 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.643 0.259 . . . . 0.0 110.33 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.16 93.54 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.732 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.6 t80 -61.58 -52.79 62.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.633 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.598 ' HA ' HD12 ' F' ' 34' ' ' LEU . 91.0 mt -59.54 -41.29 84.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.863 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -60.31 -40.88 92.15 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.139 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -65.19 -42.34 93.7 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.925 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.661 HD11 ' CE2' ' F' ' 30' ' ' PHE . 21.3 mt -61.44 -48.09 82.74 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.742 0.306 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -69.23 -44.04 72.82 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.718 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.12 -36.34 65.62 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 123.341 0.401 . . . . 0.0 111.374 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -150.93 110.69 3.09 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.721 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.37 -29.0 4.15 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.682 2.255 . . . . 0.0 113.645 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.5 p -64.83 -27.58 68.98 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -100.27 -2.04 34.77 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.49 ' HA ' HD12 ' F' ' 44' ' ' LEU . 6.7 t -52.3 -39.49 60.6 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 122.974 0.171 . . . . 0.0 111.11 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.2 -40.49 94.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.862 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -69.14 -40.58 78.16 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.799 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' F' ' 41' ' ' SER . 80.7 mt -61.12 -35.77 77.95 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.86 179.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.02 -40.16 92.5 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 123.748 0.655 . . . . 0.0 110.294 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.37 63.52 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 123.405 0.441 . . . . 0.0 110.934 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -69.04 -40.4 78.62 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.257 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.37 -47.05 87.65 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -64.51 -39.52 93.94 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.028 177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -64.61 -33.29 75.58 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.1 tp -67.45 -39.67 85.38 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 114.218 -1.355 . . . . 0.0 108.773 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -41.33 86.1 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -70.75 -37.34 73.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.306 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.9 -32.2 70.39 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.441 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . 0.402 ' OE1' HD12 ' F' ' 22' ' ' LEU . 78.3 mt-30 -91.32 -11.82 36.84 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.834 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.473 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.063 -178.709 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.253 0 CA-C-O 121.112 0.482 . . . . 0.0 111.707 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' E' ' 34' ' ' LEU . 4.2 mm? -114.26 134.61 54.81 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.113 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.448 HG21 ' SD ' ' C' ' 35' ' ' MET . 24.2 t -132.0 125.75 55.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.848 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -97.17 127.41 43.11 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 179.451 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 42.0 p90 -138.34 156.49 47.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.581 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.19 133.45 55.18 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.862 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.6 124.83 53.43 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 123.218 0.324 . . . . 0.0 110.609 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -69.42 120.01 14.56 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.457 HG11 HG13 ' C' ' 31' ' ' ILE . 10.5 m -112.01 11.03 8.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.147 -176.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.8 -46.69 0.43 Allowed Glycine 0 N--CA 1.475 1.248 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 95.5 p -56.72 174.25 0.16 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.955 0.407 . . . . 0.0 111.69 -178.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -53.3 -24.36 11.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.396 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -58.44 -24.97 61.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.74 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.4 -80.81 1.12 Allowed Glycine 0 C--N 1.34 0.805 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.9 162.73 33.27 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.457 HG13 HG11 ' C' ' 24' ' ' VAL . 4.4 mt -116.03 130.14 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.328 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -79.59 119.14 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.93 150.96 22.15 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 107.875 -2.09 . . . . 0.0 107.875 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.556 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.68 157.35 39.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.709 0.766 . . . . 0.0 111.727 -179.329 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.519 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.5 OUTLIER -102.12 146.64 27.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.872 -1.513 . . . . 0.0 108.994 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.05 126.27 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.284 0.365 . . . . 0.0 111.772 -178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.14 128.96 0.02 OUTLIER Glycine 0 C--N 1.34 0.788 0 CA-C-N 115.81 -0.632 . . . . 0.0 113.474 177.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.88 173.22 11.04 Favored Glycine 0 C--N 1.339 0.72 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 p -127.36 145.18 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.737 -0.231 . . . . 0.0 110.533 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.87 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -83.58 130.54 35.0 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -113.91 125.89 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 121.328 0.585 . . . . 0.0 110.08 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.473 HG11 HD11 ' E' ' 45' ' ' LEU . 53.1 t -106.13 146.72 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.492 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -127.95 127.53 43.46 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.444 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.48 HD13 HD22 ' E' ' 22' ' ' LEU . 30.6 mt -123.22 54.24 6.47 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 123.243 0.339 . . . . 0.0 110.884 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -63.11 -19.71 69.49 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 122.245 1.963 . . . . 0.0 111.548 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -85.97 -3.14 58.86 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.136 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.48 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -96.34 134.8 39.02 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.041 0.448 . . . . 0.0 111.146 -179.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -74.33 167.39 36.37 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.838 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.91 -35.23 88.78 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.06 1.84 . . . . 0.0 110.981 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -63.8 -46.01 87.09 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.513 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.426 ' NE2' HD11 ' E' ' 51' ' ' LEU . 30.1 mm100 -66.67 -45.82 77.64 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.231 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -64.89 -44.97 87.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.069 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.8 t -63.77 -43.26 96.9 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.352 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.53 88.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.168 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.515 ' CE2' HD22 ' E' ' 34' ' ' LEU . 47.9 t80 -63.4 -49.87 72.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.152 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.848 HD11 ' CE2' ' C' ' 19' ' ' PHE . 45.3 mt -59.1 -32.28 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.565 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -70.07 -50.6 39.44 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.733 0.301 . . . . 0.0 110.438 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.0 t -67.35 -45.08 77.42 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' C' ' 17' ' ' LEU . 40.6 tp -52.39 -39.35 60.73 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.715 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -82.44 -36.81 26.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.239 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -60.34 -41.05 92.8 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -130.4 79.24 72.81 Favored Pre-proline 0 CA--C 1.547 0.846 0 O-C-N 123.056 0.223 . . . . 0.0 110.793 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -62.31 -20.97 71.89 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 121.763 1.642 . . . . 0.0 112.017 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.4 m -59.45 -34.7 72.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.913 0.387 . . . . 0.0 110.221 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -98.58 27.88 4.55 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.211 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.06 -51.89 16.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.73 -40.32 66.2 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 121.029 -0.268 . . . . 0.0 111.614 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.462 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 20.5 m120 -61.3 -53.1 61.09 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.252 0.345 . . . . 0.0 111.467 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.01 -41.94 88.9 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.362 0.414 . . . . 0.0 110.391 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.561 HD12 ' O ' ' E' ' 45' ' ' LEU . 0.7 OUTLIER -64.41 -35.27 80.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.523 179.493 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.01 -38.4 67.84 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -69.57 -38.01 77.23 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.263 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.61 -35.2 75.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 123.773 0.671 . . . . 0.0 109.61 -179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.427 ' HE2' ' HG ' ' E' ' 45' ' ' LEU . 0.0 OUTLIER -64.94 -45.33 86.22 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mtpp -61.8 -33.8 74.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.3 176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.63 -39.07 88.11 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.66 -40.17 78.73 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.985 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.522 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 19.6 t70 -79.63 -29.52 41.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.049 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.15 -24.03 66.58 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.473 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -124.17 8.76 8.58 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.134 0.492 . . . . 0.0 110.668 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-N 115.052 -0.976 . . . . 0.0 112.016 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.699 0 CA-C-O 120.086 -0.286 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -86.59 134.2 33.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 20.1 mt -113.43 146.69 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.627 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.6 t -130.74 113.18 24.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 114.825 -1.08 . . . . 0.0 110.299 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -94.56 132.92 38.74 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.519 0.512 . . . . 0.0 109.998 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -123.34 77.14 53.42 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.665 -178.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -83.64 -57.53 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.835 2.357 . . . . 0.0 112.119 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -60.78 -26.61 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.856 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.47 152.69 4.67 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.75 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -91.5 150.96 42.1 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.739 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -57.82 -34.32 98.1 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 121.662 1.575 . . . . 0.0 111.306 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.04 -45.2 91.35 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.2 mm100 -66.27 -36.81 83.95 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.925 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 44.4 mt -64.47 -40.43 95.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.145 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.2 t -64.11 -47.95 78.02 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.58 94.83 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.667 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -61.76 -52.97 62.04 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' F' ' 34' ' ' LEU . 96.8 mt -65.84 -32.21 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.744 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -60.78 -49.63 76.73 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.056 0.222 . . . . 0.0 110.657 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 41.5 m -73.62 -39.08 64.81 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.918 0.389 . . . . 0.0 110.465 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.414 ' HB3' ' HA ' ' F' ' 31' ' ' ILE . 2.4 tp -56.29 -41.87 76.61 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.953 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.7 t-80 -82.03 -53.54 6.04 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.133 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.14 -35.42 73.46 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -128.69 83.72 65.32 Favored Pre-proline 0 CA--C 1.538 0.489 0 O-C-N 123.157 0.286 . . . . 0.0 110.612 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -56.35 -31.46 85.09 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 122.542 2.161 . . . . 0.0 111.688 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 43.2 t -62.47 -29.88 70.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.963 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -92.18 -10.97 36.81 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.498 0.499 . . . . 0.0 112.074 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -51.65 -44.92 63.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.14 -51.23 69.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.964 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -64.13 -38.22 90.29 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 23.0 mt -64.16 -36.01 82.67 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.522 179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -40.92 89.83 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.778 0.674 . . . . 0.0 110.25 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.52 -60.08 3.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.692 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -61.53 -38.57 87.88 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.41 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.44 85.72 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -62.79 -36.58 83.6 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.039 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 50.6 mttt -69.82 -34.41 73.63 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.2 tp -62.9 -37.86 88.65 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.668 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.35 -42.68 87.45 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -71.56 -34.03 69.63 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.372 178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.99 -31.75 66.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.651 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -95.92 -4.46 43.42 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.04 0.448 . . . . 0.0 110.618 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.886 -179.105 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.692 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER -124.23 145.5 49.32 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -136.52 138.36 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 123.057 0.223 . . . . 0.0 110.99 -178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -103.83 125.69 50.44 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 177.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 39.7 p90 -137.07 161.1 37.02 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 123.846 0.716 . . . . 0.0 111.52 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.42 131.13 54.65 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.654 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.02 120.9 42.04 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.65 114.46 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.558 HG11 ' CD1' ' C' ' 31' ' ' ILE . 22.1 m -115.02 -31.32 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.604 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.2 10.77 2.86 Favored Glycine 0 CA--C 1.534 1.268 0 O-C-N 123.329 0.393 . . . . 0.0 113.265 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 31.2 m -87.5 59.5 5.51 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.201 0.5 . . . . 0.0 109.681 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 24.0 m120 61.88 35.97 16.13 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.386 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -145.55 -23.51 0.47 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.288 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.03 -75.47 2.38 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 107.712 -2.155 . . . . 0.0 107.712 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . 0.57 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -142.62 158.41 43.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.145 -0.528 . . . . 0.0 110.023 177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.558 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -111.1 133.54 56.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 CA-C-N 116.363 -0.381 . . . . 0.0 109.988 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -81.27 117.39 27.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.76 147.21 19.1 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.435 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -125.86 156.31 39.83 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.34 0.59 . . . . 0.0 110.962 -179.46 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 4.8 ptm -106.06 144.96 32.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 18.0 t -119.19 122.37 69.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 109.07 148.69 12.93 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.5 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -42.7 -57.73 3.83 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.061 -0.57 . . . . 0.0 111.782 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 23.4 t -141.6 149.11 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.078 0.465 . . . . 0.0 111.091 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.91 179.293 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 CA-C-O 121.441 0.467 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -107.53 132.81 52.84 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -108.16 127.24 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 121.606 0.717 . . . . 0.0 111.449 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.434 HG21 ' HE2' ' E' ' 49' ' ' LYS . 42.6 t -107.15 143.57 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-N 114.152 -1.386 . . . . 0.0 112.097 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -125.27 126.39 45.05 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.473 HD13 HD22 ' E' ' 22' ' ' LEU . 21.9 mt -122.99 54.21 6.13 Favored Pre-proline 0 CA--C 1.548 0.868 0 O-C-N 123.197 0.31 . . . . 0.0 110.776 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.511 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.3 Cg_endo -62.42 -16.54 52.44 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.46 2.107 . . . . 0.0 111.409 178.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.7 m-20 -86.33 -6.35 58.97 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.252 -178.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.473 HD22 HD13 ' E' ' 19' ' ' LEU . 9.5 mp -95.08 128.52 41.97 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 120.848 0.356 . . . . 0.0 111.484 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.487 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.4 p30 -68.48 158.71 84.25 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.806 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -51.98 -36.37 64.32 Favored 'Trans proline' 0 N--CA 1.498 1.786 0 C-N-CA 122.335 2.023 . . . . 0.0 112.345 -178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -64.63 -47.09 79.81 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 123.369 0.418 . . . . 0.0 109.978 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -64.23 -42.93 96.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.04 -40.51 97.93 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 62.4 m -64.82 -40.6 95.47 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.58 92.39 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.036 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 27.1 t80 -67.24 -52.6 38.96 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.726 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.5 mt -58.97 -37.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -64.15 -50.33 68.61 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.097 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 20.3 t -68.66 -40.34 80.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.304 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.692 HD21 HD22 ' C' ' 17' ' ' LEU . 57.4 tp -57.91 -41.42 82.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.63 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -76.84 -50.53 13.2 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.461 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.69 -38.54 81.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.315 -178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -121.44 81.25 38.65 Favored Pre-proline 0 CA--C 1.54 0.585 0 O-C-N 123.237 0.335 . . . . 0.0 110.909 -178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.86 -29.08 29.02 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.518 2.145 . . . . 0.0 111.992 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -59.95 -36.29 76.76 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.627 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -95.69 14.89 21.6 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.264 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 71.0 p -50.46 -43.52 55.28 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.65 -48.15 73.11 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.061 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.03 -45.09 93.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.767 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 51.2 mt -60.28 -39.23 86.13 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.736 0.648 . . . . 0.0 110.631 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.639 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -63.81 -37.65 88.16 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.709 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.43 -34.03 68.51 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.078 0.466 . . . . 0.0 110.484 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -69.99 -43.3 71.74 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.376 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.477 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.69 -31.88 68.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.753 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.639 ' CE ' HD22 ' E' ' 45' ' ' LEU . 31.9 mttt -70.9 -40.81 71.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -62.14 -30.91 71.37 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -71.36 -40.04 70.89 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.836 177.172 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -56.33 -39.65 73.16 Favored 'General case' 0 C--N 1.349 0.565 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -79.46 -32.94 42.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.678 -1.147 . . . . 0.0 110.546 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.96 -32.6 73.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.947 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.487 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.8 mt-30 -112.3 8.33 19.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.179 0.514 . . . . 0.0 110.932 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.729 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.971 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.676 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.11 142.46 27.69 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.639 0.257 . . . . 0.0 110.39 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.89 145.24 21.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.612 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 10.5 t -129.78 117.09 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.035 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -94.59 135.7 35.74 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.501 0.5 . . . . 0.0 110.517 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 15.1 mt -123.0 76.13 49.99 Favored Pre-proline 0 CA--C 1.546 0.798 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.075 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -85.58 -50.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 123.11 2.54 . . . . 0.0 112.991 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -81.0 9.02 7.12 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.564 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.34 153.6 24.51 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.843 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -89.97 150.51 43.76 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -61.21 -32.58 90.75 Favored 'Trans proline' 0 N--CA 1.493 1.46 0 C-N-CA 121.423 1.416 . . . . 0.0 110.76 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.78 -43.46 90.44 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -67.58 -37.51 82.71 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.26 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.22 -43.5 97.94 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.669 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -62.34 -46.67 87.65 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.13 -39.15 93.86 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.74 -0.663 . . . . 0.0 109.813 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -65.53 -53.81 36.98 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -62.77 -36.93 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.465 0.478 . . . . 0.0 111.861 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -60.78 -48.18 82.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.644 0.259 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 9.4 m -73.04 -38.96 66.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.359 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' C' ' 30' ' ' ALA . 13.0 tp -58.71 -42.02 87.71 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.757 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -81.22 -46.71 14.42 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.124 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -58.89 -38.38 78.74 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.35 0.406 . . . . 0.0 111.691 -178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -122.34 86.98 48.31 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 123.356 0.41 . . . . 0.0 110.658 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.22 -38.15 68.42 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 122.419 2.08 . . . . 0.0 111.973 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 27.0 m -63.57 -35.88 81.95 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.867 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -93.66 -4.85 49.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.402 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.506 ' HB2' HD12 ' F' ' 34' ' ' LEU . 0.3 OUTLIER -53.89 -41.48 67.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.134 0.493 . . . . 0.0 110.106 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.63 97.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.785 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.74 -40.1 96.19 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.07 -33.28 75.41 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.408 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.79 -39.54 92.08 Favored 'General case' 0 C--N 1.34 0.187 0 O-C-N 123.499 0.499 . . . . 0.0 109.788 179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -51.52 64.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.578 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -67.6 -40.23 84.76 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.161 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.35 -47.14 85.53 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt -63.85 -35.62 81.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.449 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -69.48 -34.69 74.71 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' F' ' 51' ' ' LEU . 12.0 tp -65.41 -39.31 91.99 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.361 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.17 -41.35 88.23 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 177.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -70.46 -35.1 73.11 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.163 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.93 68.89 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.12 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -95.6 -4.84 43.83 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.337 0.398 . . . . 0.0 110.875 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.343 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.686 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' E' ' 41' ' ' SER . 0.9 OUTLIER -109.41 145.44 36.12 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.215 0.531 . . . . 0.0 111.272 179.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.446 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 12.0 t -139.77 135.57 38.9 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.637 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.815 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.32 128.49 46.37 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.496 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -139.73 157.77 45.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.8 137.68 54.68 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.003 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.424 ' O ' HG13 ' C' ' 24' ' ' VAL . 1.8 mt-10 -113.49 133.9 54.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.89 110.27 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.44 HG11 HG13 ' C' ' 31' ' ' ILE . 10.9 m -114.15 -11.88 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.332 -177.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.37 -128.89 39.56 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 109.358 -1.497 . . . . 0.0 109.358 -178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 22.3 t 52.13 23.51 2.32 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.03 4.44 4.06 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.181 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 24.3 mtmm -94.43 -5.26 46.7 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.346 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.22 -104.21 1.0 Allowed Glycine 0 C--N 1.338 0.683 0 N-CA-C 108.821 -1.712 . . . . 0.0 108.821 -178.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' C' ' 22' ' ' GLU . . . -127.01 163.05 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.639 0.258 . . . . 0.0 110.637 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.44 HG13 HG11 ' C' ' 24' ' ' VAL . 43.6 mt -112.23 132.65 60.33 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.091 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.443 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.8 mm -82.64 116.29 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 147.48 19.25 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 108.452 -1.859 . . . . 0.0 108.452 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.601 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -124.36 155.0 39.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.601 0.715 . . . . 0.0 110.931 -179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.446 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 0.7 OUTLIER -100.05 146.65 26.51 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 113.977 -1.465 . . . . 0.0 108.639 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 t -125.54 125.37 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 O-C-N 123.48 0.488 . . . . 0.0 110.366 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.53 34.76 89.56 Favored Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.33 -169.13 44.07 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-O 121.454 0.475 . . . . 0.0 111.998 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . 0.422 HG23 ' O ' ' C' ' 39' ' ' VAL . 30.2 m -139.86 116.75 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 114.225 -0.987 . . . . 0.0 109.533 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 C--O 1.221 -0.414 0 CA-C-O 118.312 -0.851 . . . . 0.0 109.778 -179.254 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -77.43 124.82 28.4 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -109.56 128.4 65.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 121.52 0.676 . . . . 0.0 111.368 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.538 HG21 HD21 ' E' ' 45' ' ' LEU . 50.6 t -106.07 146.28 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.007 -178.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -126.49 129.37 48.53 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.368 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.438 HD13 HD22 ' E' ' 22' ' ' LEU . 53.6 mt -124.67 51.94 5.44 Favored Pre-proline 0 CA--C 1.546 0.802 0 O-C-N 123.312 0.382 . . . . 0.0 111.358 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.436 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -63.05 -20.28 71.02 Favored 'Trans proline' 0 N--CA 1.499 1.839 0 C-N-CA 122.265 1.976 . . . . 0.0 111.261 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -83.69 -6.52 59.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.11 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.438 HD22 HD13 ' E' ' 19' ' ' LEU . 10.3 mp -94.22 132.95 38.26 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.984 0.421 . . . . 0.0 111.341 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.455 ' ND2' HE22 ' E' ' 55' ' ' GLN . 4.2 p30 -71.88 158.63 87.37 Favored Pre-proline 0 C--O 1.237 0.418 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.563 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.07 -34.71 58.83 Favored 'Trans proline' 0 N--CA 1.499 1.85 0 C-N-CA 122.176 1.917 . . . . 0.0 112.356 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.17 -45.87 83.16 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -66.96 -42.94 84.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.73 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.55 -42.43 99.54 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.26 -39.58 92.82 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.85 90.29 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.129 0.49 . . . . 0.0 110.09 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -65.09 -52.21 56.84 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.402 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.815 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.6 mt -59.16 -38.23 73.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.483 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -64.2 -50.05 69.57 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.918 0.389 . . . . 0.0 110.169 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -69.56 -39.83 77.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.22 -40.68 77.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.445 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -81.72 -33.87 30.89 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.33 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.51 -39.26 79.61 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -140.2 86.48 12.9 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 123.21 0.319 . . . . 0.0 110.696 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.22 -25.86 48.71 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 122.512 2.141 . . . . 0.0 112.175 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -37.15 86.23 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -90.3 9.68 27.78 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.68 ' HB2' HD13 ' C' ' 17' ' ' LEU . 87.6 p -54.23 -40.39 67.63 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.43 -46.63 69.36 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.572 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -63.84 -49.13 74.03 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.158 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 58.4 mt -58.17 -44.97 88.23 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.634 0.584 . . . . 0.0 110.56 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.538 HD21 HG21 ' E' ' 17' ' ' VAL . 14.5 tp -62.74 -38.2 89.58 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.812 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.5 -34.96 51.89 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -77.17 -40.43 45.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.17 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -66.83 -31.52 72.18 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 121.388 0.613 . . . . 0.0 109.415 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.503 ' HE2' HD21 ' E' ' 45' ' ' LEU . 16.5 mmtt -65.68 -43.95 87.7 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -60.24 -36.0 76.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.46 -1.246 . . . . 0.0 107.787 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.5 OUTLIER -64.17 -39.11 93.32 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.177 178.016 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 47.1 t30 -56.66 -39.76 74.31 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -80.25 -29.0 38.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.205 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -69.57 -31.29 69.38 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.057 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.455 HE22 ' ND2' ' E' ' 23' ' ' ASN . 18.8 mt-30 -115.26 8.59 15.52 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.726 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.939 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.59 0 CA-C-O 120.052 -0.305 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -89.85 138.14 31.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.67 -0.412 . . . . 0.0 109.916 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 97.5 mt -114.38 146.77 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.151 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . 0.408 HG23 HD23 ' F' ' 45' ' ' LEU . 21.9 t -131.08 122.07 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.571 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -99.85 137.41 38.36 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.52 0.512 . . . . 0.0 110.541 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.62 HD12 HD13 ' F' ' 22' ' ' LEU . 2.2 mm? -116.0 72.26 4.42 Favored Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.833 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -80.38 -51.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.681 2.254 . . . . 0.0 113.188 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -85.6 3.98 38.27 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.62 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -76.96 152.38 35.29 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.409 ' ND2' ' H ' ' F' ' 26' ' ' GLN . 10.2 p-10 -94.72 149.52 36.57 Favored Pre-proline 0 N--CA 1.471 0.605 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -53.66 -39.64 82.45 Favored 'Trans proline' 0 N--CA 1.499 1.805 0 C-N-CA 122.426 2.084 . . . . 0.0 113.622 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -61.74 -39.38 91.38 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.688 ' HG2' HD13 ' F' ' 51' ' ' LEU . 60.4 tp60 -73.17 -37.78 66.41 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.987 178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.85 -41.02 92.24 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.538 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -62.16 -45.35 93.82 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.98 -35.53 80.49 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.659 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.633 ' CE2' HD11 ' F' ' 34' ' ' LEU . 24.7 t80 -62.68 -53.83 48.58 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.979 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 87.3 mt -58.88 -41.06 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 123.489 0.493 . . . . 0.0 110.808 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -59.24 -39.73 83.72 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 4.5 t -66.28 -42.08 88.9 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.341 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.633 HD11 ' CE2' ' F' ' 30' ' ' PHE . 70.4 mt -58.52 -41.81 86.28 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.821 0.343 . . . . 0.0 110.107 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -74.27 -38.67 63.35 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.39 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.7 -38.99 70.42 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.223 0.327 . . . . 0.0 111.181 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -152.47 109.82 2.77 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.459 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.64 -38.8 30.05 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.074 1.849 . . . . 0.0 112.48 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 10.6 t -60.66 -38.28 84.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.564 0.221 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -69.88 -21.08 63.36 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 83.0 p -46.79 -40.58 13.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.0 0.371 . . . . 0.0 112.0 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.71 -51.74 67.12 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.324 0.39 . . . . 0.0 111.044 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -64.71 -39.32 93.46 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 49.4 mt -62.93 -34.88 78.38 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.505 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . 0.408 HD23 HG23 ' F' ' 17' ' ' VAL . 0.8 OUTLIER -61.68 -38.05 86.35 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.141 179.548 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.51 -50.86 67.96 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.581 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.09 -40.98 78.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.773 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.77 -42.31 97.22 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -66.86 -38.68 86.8 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.688 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -61.5 -35.74 78.52 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.002 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.688 HD13 ' HG2' ' F' ' 26' ' ' GLN . 49.6 mt -61.82 -39.8 93.06 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 123.101 0.25 . . . . 0.0 110.372 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.9 -35.8 69.4 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -78.58 -36.5 44.32 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.424 178.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.26 -32.02 66.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.837 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -96.93 -6.72 34.99 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.922 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.988 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.585 0.707 . . . . 0.0 111.425 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.555 HD22 HD21 ' E' ' 34' ' ' LEU . 0.4 OUTLIER -114.44 150.41 34.78 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.484 -1.234 . . . . 0.0 109.558 179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.8 t -139.65 126.96 24.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.296 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.796 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.857 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.0 OUTLIER -93.81 123.66 37.3 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.4 p90 -135.62 155.4 50.5 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.054 0.846 . . . . 0.0 111.375 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.48 137.59 54.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.377 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -101.4 140.98 34.95 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.534 0.521 . . . . 0.0 109.698 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -78.73 110.7 14.12 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.541 HG21 HG13 ' C' ' 31' ' ' ILE . 20.1 t -122.1 73.77 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.835 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.71 5.8 1.6 Allowed Glycine 0 CA--C 1.535 1.291 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.822 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 61.5 m -78.96 47.6 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 117.247 0.523 . . . . 0.0 110.538 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 15.3 t30 62.12 37.7 14.36 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.133 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -142.02 -1.31 1.24 Allowed 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.204 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.51 -106.31 1.42 Allowed Glycine 0 C--O 1.219 -0.815 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.08 156.44 48.26 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 117.425 0.613 . . . . 0.0 110.724 178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.541 HG13 HG21 ' C' ' 24' ' ' VAL . 65.2 mt -109.17 140.03 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.337 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -90.91 115.33 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 123.586 0.554 . . . . 0.0 109.724 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.51 141.78 13.19 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 108.41 -1.876 . . . . 0.0 108.41 178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.564 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -119.35 159.33 24.36 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.507 0.67 . . . . 0.0 110.69 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.64 146.19 35.2 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.283 -1.326 . . . . 0.0 109.715 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.8 t -127.31 123.11 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 O-C-N 124.066 0.854 . . . . 0.0 110.653 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 57.79 63.86 4.89 Favored Glycine 0 C--N 1.34 0.801 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -130.11 -159.66 9.82 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.2 p -136.47 141.56 40.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.537 -0.331 . . . . 0.0 110.556 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.845 179.516 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 N-CA-C 110.819 -0.913 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -86.42 118.11 25.64 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mt -104.14 126.9 58.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 120.959 0.409 . . . . 0.0 110.659 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.29 142.86 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.217 -0.901 . . . . 0.0 112.079 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -124.36 128.98 49.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.364 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 20.9 mt -123.62 59.16 15.57 Favored Pre-proline 0 CA--C 1.544 0.73 0 O-C-N 123.217 0.323 . . . . 0.0 110.706 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.509 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.2 Cg_endo -70.63 -21.47 29.4 Favored 'Trans proline' 0 N--CA 1.5 1.871 0 C-N-CA 122.733 2.289 . . . . 0.0 111.373 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 78.2 m-20 -82.99 -4.68 58.56 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.899 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.34 144.3 26.62 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.882 0.372 . . . . 0.0 110.532 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -86.53 162.43 45.28 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.307 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.44 -32.84 44.43 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.013 1.809 . . . . 0.0 112.215 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.36 -47.2 80.22 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -66.23 -46.97 75.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.402 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.7 mt -63.22 -40.37 97.27 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.063 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 t -66.87 -43.03 84.6 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.75 -45.67 91.6 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.854 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 48.3 t80 -62.38 -49.64 74.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.976 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.857 HD11 ' CE2' ' C' ' 19' ' ' PHE . 50.9 mt -61.65 -32.59 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.906 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 48.3 t60 -67.32 -50.21 61.06 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.065 0.46 . . . . 0.0 109.903 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.92 -43.07 84.29 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.872 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.555 HD21 HD22 ' C' ' 17' ' ' LEU . 60.8 tp -57.01 -41.23 78.14 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.6 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -73.97 -47.71 35.43 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.333 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -57.34 -40.3 77.73 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.097 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -123.34 84.69 52.13 Favored Pre-proline 0 CA--C 1.538 0.5 0 O-C-N 123.332 0.395 . . . . 0.0 110.484 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.92 -36.17 10.87 Favored 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 122.551 2.167 . . . . 0.0 112.791 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 38.6 t -60.11 -35.65 75.7 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.295 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -93.1 8.65 39.19 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.627 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.403 ' HB3' HD13 ' C' ' 17' ' ' LEU . 19.1 m -47.53 -41.66 21.6 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.28 -44.56 91.28 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.857 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -67.47 -46.05 74.17 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.553 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.93 -38.91 80.06 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.02 -38.0 89.48 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.816 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.46 -37.71 65.52 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -68.94 -39.58 79.49 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.491 179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.528 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -69.31 -32.17 71.12 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.475 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.55 -40.32 89.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.66 -37.34 83.7 Favored 'General case' 0 C--N 1.346 0.452 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.451 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.8 OUTLIER -64.44 -39.76 94.44 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.8 177.63 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 38.2 t30 -56.2 -40.57 74.19 Favored 'General case' 0 C--N 1.345 0.407 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.4 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 50.3 m-20 -80.99 -27.97 35.7 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.44 177.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.451 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -68.28 -31.09 70.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.135 -178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -116.59 8.2 13.83 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.161 0.505 . . . . 0.0 110.706 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.442 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.733 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.928 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -63.14 143.27 57.93 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.37 -0.415 . . . . 0.0 110.034 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 65.1 mt -115.07 140.34 36.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.887 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 20.4 t -117.45 117.62 55.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.725 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.27 133.55 39.03 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -122.88 77.14 49.46 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.503 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -83.95 -49.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 123.068 2.512 . . . . 0.0 113.333 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -83.28 5.02 24.59 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.429 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.5 OUTLIER -76.56 152.68 35.88 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.725 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -82.88 145.51 50.17 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -57.63 -34.3 97.91 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 121.506 1.471 . . . . 0.0 110.781 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -59.37 -43.56 92.86 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -65.46 -35.69 81.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.411 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 49.4 mt -64.03 -43.7 94.76 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.244 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 13.5 t -61.5 -47.34 86.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.64 -39.82 95.32 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.835 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.41 ' CE1' HD21 ' F' ' 34' ' ' LEU . 26.0 t80 -62.83 -54.13 43.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.734 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.2 mt -58.76 -39.37 76.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.944 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -61.29 -40.37 93.89 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 22.9 m -65.38 -39.67 92.53 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.119 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' F' ' 30' ' ' PHE . 73.8 mt -58.7 -40.31 83.27 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 120.924 0.392 . . . . 0.0 110.152 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -73.35 -39.32 65.29 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.165 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -56.1 -42.87 77.47 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.26 104.01 3.32 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.286 0.366 . . . . 0.0 110.451 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -53.27 -38.07 81.42 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.314 2.009 . . . . 0.0 112.258 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -61.28 -39.54 90.81 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.044 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -68.67 -23.43 64.4 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 80.1 p -46.94 -42.35 17.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.31 77.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.786 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -65.98 -41.85 90.59 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.969 0.414 . . . . 0.0 109.98 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 32.7 mt -60.92 -34.39 74.62 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.77 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -38.65 90.1 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.859 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.61 57.1 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -67.01 -40.52 87.31 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.657 -0.247 . . . . 0.0 110.591 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.83 98.26 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.394 0.616 . . . . 0.0 109.385 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -65.9 -38.34 88.46 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.98 177.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -63.01 -35.93 81.86 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.17 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' F' ' 51' ' ' LEU . 26.1 mt -62.45 -39.1 92.26 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.99 -36.95 70.96 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 178.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -78.03 -36.49 48.49 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.548 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.63 64.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.931 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -97.52 -5.79 35.05 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.989 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.418 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.486 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.83 ' HG ' HD21 ' E' ' 34' ' ' LEU . 1.3 mm? -85.35 145.21 27.61 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.41 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.3 t -134.45 131.53 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.266 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.866 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.7 OUTLIER -106.27 128.3 53.87 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.421 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.3 p90 -138.29 156.09 47.98 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 123.606 0.566 . . . . 0.0 111.295 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.0 132.97 56.5 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.672 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.46 127.77 52.22 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.077 -179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -75.36 116.98 16.67 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.493 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.1 m -123.46 -13.01 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.197 -177.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.04 -124.89 38.12 Favored Glycine 0 C--N 1.339 0.744 0 N-CA-C 109.114 -1.594 . . . . 0.0 109.114 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.5 m 49.36 28.3 2.28 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 13.7 t30 68.7 0.64 2.73 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.18 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 33.0 mtmm -94.38 -5.64 45.98 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.433 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.85 -98.3 0.47 Allowed Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.428 -1.469 . . . . 0.0 109.428 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.73 163.55 29.2 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.633 0.254 . . . . 0.0 110.491 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.545 HG23 ' HB3' ' E' ' 20' ' ' PRO . 54.4 mt -113.17 135.72 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -84.44 116.0 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 O-C-N 123.671 0.607 . . . . 0.0 109.747 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.74 145.57 17.65 Favored Glycine 0 N--CA 1.453 -0.194 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.474 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.32 163.13 21.35 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.452 0.644 . . . . 0.0 111.453 -179.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.436 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.3 OUTLIER -112.84 143.64 43.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.429 179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.0 t -124.82 120.02 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 O-C-N 123.631 0.582 . . . . 0.0 110.314 -179.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.94 105.77 2.46 Favored Glycine 0 N--CA 1.471 0.996 0 CA-C-N 116.352 -0.385 . . . . 0.0 112.577 178.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.64 -155.41 8.26 Favored Glycine 0 C--N 1.341 0.819 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 6.8 p -140.66 149.78 21.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.308 -0.446 . . . . 0.0 110.271 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . 0.415 ' H ' ' HE1' ' C' ' 35' ' ' MET . 87.1 t . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.914 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.965 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.74 129.46 39.97 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -107.34 127.35 63.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 121.369 0.604 . . . . 0.0 110.583 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.441 HG21 ' HE2' ' E' ' 49' ' ' LYS . 43.1 t -112.8 145.14 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.066 -178.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -124.95 129.32 50.12 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.424 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.2 mt -125.24 59.33 23.59 Favored Pre-proline 0 CA--C 1.545 0.77 0 O-C-N 123.245 0.341 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.545 ' HB3' HG23 ' C' ' 31' ' ' ILE . 40.4 Cg_endo -69.83 -20.43 34.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 122.628 2.219 . . . . 0.0 111.407 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.455 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 71.6 m-20 -86.6 -3.4 59.02 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.557 -177.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.4 mp -96.83 134.08 40.6 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.018 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -71.27 160.25 83.1 Favored Pre-proline 0 C--O 1.235 0.331 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.652 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -52.99 -31.54 53.76 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.031 1.821 . . . . 0.0 111.39 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.99 -48.94 69.55 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.572 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.26 -46.02 90.67 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.663 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 87.0 mt -63.26 -38.16 90.07 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.9 m -67.49 -42.47 82.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.52 98.73 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 109.765 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.499 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 25.4 t80 -67.15 -53.52 29.82 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.579 179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.866 HD11 ' CE2' ' C' ' 19' ' ' PHE . 72.7 mt -60.88 -32.66 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -66.91 -50.48 62.27 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.915 0.388 . . . . 0.0 110.025 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 13.2 t -72.34 -37.47 68.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.426 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.83 HD21 ' HG ' ' C' ' 17' ' ' LEU . 49.1 tp -58.04 -38.57 76.5 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.626 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -82.47 -53.49 5.94 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.709 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.87 -35.94 82.74 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -178.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -116.77 75.27 7.05 Favored Pre-proline 0 N--CA 1.472 0.666 0 O-C-N 123.097 0.248 . . . . 0.0 111.34 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.06 -18.4 45.91 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 122.159 1.906 . . . . 0.0 111.274 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 24.7 m -59.63 -30.69 68.88 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.83 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 93.5 mm-40 -110.03 29.83 7.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.695 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 28.7 t -50.76 -51.2 52.6 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.97 -38.81 44.32 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.208 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -61.2 -51.96 66.8 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 112.016 -178.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -55.72 -46.5 77.73 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 120.978 0.418 . . . . 0.0 111.375 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.47 HD12 ' O ' ' E' ' 45' ' ' LEU . 11.9 tp -62.98 -36.29 83.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.366 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.84 -35.45 68.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -74.55 -38.24 62.79 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.268 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.68 69.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.441 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -68.36 -38.25 81.25 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 177.368 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -64.92 -36.75 85.39 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.523 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -64.62 -38.18 90.12 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 115.504 -0.771 . . . . 0.0 108.97 177.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.02 -40.23 69.95 Favored 'General case' 0 C--N 1.344 0.36 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -81.77 -31.05 32.09 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.704 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -33.76 76.19 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.463 -178.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -113.1 7.82 18.12 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.14 0.495 . . . . 0.0 110.79 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.761 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.074 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.646 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -71.0 144.64 50.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -115.31 143.22 25.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.154 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . 0.401 HG23 HD23 ' F' ' 45' ' ' LEU . 25.2 t -127.17 121.74 58.37 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.334 -179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.421 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.9 m-85 -98.99 136.81 38.43 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.542 0.526 . . . . 0.0 111.14 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.83 HD12 HD13 ' F' ' 22' ' ' LEU . 2.9 mm? -117.36 72.35 7.0 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.87 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.59 -53.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.693 2.262 . . . . 0.0 112.759 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -85.97 7.03 25.98 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.898 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.83 HD13 HD12 ' F' ' 19' ' ' LEU . 0.6 OUTLIER -78.85 150.7 32.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.6 145.4 75.19 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.44 -35.55 48.9 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 121.509 1.473 . . . . 0.0 111.048 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -62.1 -36.39 81.57 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -65.15 -39.56 93.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.433 178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' F' ' 27' ' ' LEU . 76.8 mt -61.82 -40.89 96.84 Favored 'General case' 0 C--N 1.35 0.599 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.18 -47.79 84.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.22 -39.46 94.7 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.468 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.662 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.1 t80 -64.38 -54.64 29.64 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.015 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.687 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.2 mt -57.92 -40.81 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -61.34 -41.22 96.69 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.015 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 32.5 m -65.61 -40.62 92.84 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.181 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' F' ' 31' ' ' ILE . 22.3 mt -60.2 -39.29 86.06 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -82.04 -32.88 30.21 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.844 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.22 -41.61 93.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.158 0.286 . . . . 0.0 111.023 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -151.62 84.47 5.08 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.242 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.23 -23.69 30.91 Favored 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 123.263 2.642 . . . . 0.0 113.194 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 68.8 p -62.3 -31.81 72.47 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.179 0.299 . . . . 0.0 111.225 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -105.51 8.82 33.56 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.555 ' HA ' HD12 ' F' ' 44' ' ' LEU . 4.9 t -53.41 -38.92 63.89 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.72 0.295 . . . . 0.0 110.398 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.19 99.41 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.479 177.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.67 -41.57 95.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' F' ' 41' ' ' SER . 43.6 mt -62.03 -36.6 82.09 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.484 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . 0.401 HD23 HG23 ' F' ' 17' ' ' VAL . 1.0 OUTLIER -60.92 -40.28 92.62 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.306 179.31 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.92 -59.11 5.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.559 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -62.52 -41.09 98.61 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.366 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.11 -42.87 91.57 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.5 ttmt -66.94 -39.06 87.2 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.82 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttt -66.45 -33.57 76.0 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.503 HD23 HD11 ' F' ' 22' ' ' LEU . 11.2 tp -62.46 -38.39 89.6 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.79 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.03 -40.33 84.67 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -73.84 -34.42 64.53 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.555 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.58 -34.14 67.24 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -103.37 5.33 37.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.757 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.346 -178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.543 HD13 ' OG ' ' E' ' 41' ' ' SER . 0.7 OUTLIER -119.36 148.06 43.63 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.994 179.357 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 3.9 t -141.99 134.68 28.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.429 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.813 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -97.88 130.18 44.79 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.438 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 48.1 p90 -141.75 155.59 45.62 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.431 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.35 130.08 56.58 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.402 ' O ' HG13 ' C' ' 24' ' ' VAL . 31.7 tt0 -103.44 128.31 50.63 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.886 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.69 117.6 16.71 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.533 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.7 m -122.69 -5.63 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.386 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.47 -120.04 16.51 Favored Glycine 0 C--N 1.34 0.785 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.5 p 40.19 34.86 0.23 Allowed 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.96 1.8 1.24 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.074 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -96.02 -5.89 40.05 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.361 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.86 -102.3 0.89 Allowed Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . 0.67 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -128.52 167.5 17.01 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.533 ' CD1' HG11 ' C' ' 24' ' ' VAL . 53.4 mt -117.59 134.61 60.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.461 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.451 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.2 mm -83.85 118.59 31.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 O-C-N 123.709 0.63 . . . . 0.0 109.655 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.1 151.4 21.01 Favored Glycine 0 N--CA 1.452 -0.241 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -126.97 152.07 47.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.693 0.759 . . . . 0.0 111.108 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.91 145.31 26.57 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.97 -1.468 . . . . 0.0 109.072 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -128.46 124.18 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 52.86 58.29 11.96 Favored Glycine 0 C--N 1.346 1.086 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -136.15 -168.42 11.49 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.7 p -136.87 143.71 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.607 -0.296 . . . . 0.0 110.656 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 118.325 -0.845 . . . . 0.0 110.597 179.591 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.11 120.3 20.43 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mt -109.3 126.97 66.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.499 0.666 . . . . 0.0 110.725 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 57.8 t -106.83 146.12 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 114.381 -1.282 . . . . 0.0 112.058 -178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -125.37 129.21 49.45 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.418 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.523 HD13 HD22 ' E' ' 22' ' ' LEU . 76.9 mt -124.41 57.89 15.33 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 123.25 0.344 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.506 ' HB3' HG23 ' C' ' 31' ' ' ILE . 33.3 Cg_endo -67.31 -20.1 49.26 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 122.623 2.215 . . . . 0.0 111.698 178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.414 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.0 m-20 -88.79 -1.24 57.98 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 112.679 -177.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.523 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -95.55 127.33 41.5 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.09 0.471 . . . . 0.0 111.186 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.493 ' ND2' HE22 ' E' ' 55' ' ' GLN . 3.8 p30 -68.22 161.34 69.51 Favored Pre-proline 0 CA--C 1.536 0.406 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.726 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.46 -37.16 72.37 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.12 1.88 . . . . 0.0 112.257 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.58 -42.52 98.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.3 -47.98 68.99 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.793 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 92.7 mt -61.44 -39.17 89.85 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.2 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.0 -42.76 80.25 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.34 95.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.183 0.515 . . . . 0.0 109.896 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.596 ' CE2' HD22 ' E' ' 34' ' ' LEU . 72.4 t80 -66.55 -53.34 35.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.76 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.813 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.9 mt -59.5 -31.48 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.183 -179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -67.93 -49.82 59.6 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.006 0.431 . . . . 0.0 110.81 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.0 t -76.72 -37.46 56.0 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.225 -178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.596 HD22 ' CE2' ' E' ' 30' ' ' PHE . 45.2 tp -55.96 -42.94 77.0 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.192 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -75.39 -39.19 59.4 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.072 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.62 -40.19 91.01 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.782 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -125.8 82.74 63.68 Favored Pre-proline 0 N--CA 1.471 0.601 0 O-C-N 123.288 0.368 . . . . 0.0 110.469 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.46 -29.39 20.6 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 122.499 2.133 . . . . 0.0 112.321 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 13.0 p -62.29 -35.89 80.42 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.736 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -94.74 6.69 48.2 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.822 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.543 ' OG ' HD13 ' C' ' 17' ' ' LEU . 26.3 t -48.82 -42.18 35.26 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.77 -47.95 82.87 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.795 -0.362 . . . . 0.0 111.071 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.3 m120 -64.0 -47.5 80.07 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.259 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.82 -40.16 83.33 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.973 0.795 . . . . 0.0 110.599 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -64.27 -37.33 87.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.533 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -53.76 -38.58 64.58 Favored 'General case' 0 C--N 1.337 0.047 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.35 -39.98 77.78 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.643 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' E' ' 45' ' ' LEU . . . -69.67 -30.68 68.4 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.474 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -67.59 -39.12 84.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 177.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.37 -38.89 92.92 Favored 'General case' 0 C--N 1.345 0.406 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.6 OUTLIER -63.7 -38.28 90.53 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.192 177.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.435 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 41.7 t30 -55.13 -40.51 70.62 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -80.98 -32.33 34.4 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.791 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.57 -33.73 76.33 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.943 -0.572 . . . . 0.0 112.435 -178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.493 HE22 ' ND2' ' E' ' 23' ' ' ASN . 20.6 mt-30 -111.66 7.67 20.51 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.206 0.526 . . . . 0.0 110.868 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.69 0 CA-C-N 114.84 -1.073 . . . . 0.0 112.135 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.21 144.03 56.89 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 89.6 mt -117.38 142.87 29.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.182 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.7 t -129.75 122.44 54.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.501 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.513 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.7 m-85 -99.83 142.81 30.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 123.474 0.483 . . . . 0.0 110.961 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.954 HD12 HD13 ' F' ' 22' ' ' LEU . 3.8 mm? -117.76 78.07 11.93 Favored Pre-proline 0 CA--C 1.548 0.868 0 CA-C-N 115.234 -0.893 . . . . 0.0 109.85 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.34 -56.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.879 2.386 . . . . 0.0 113.505 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -80.45 0.03 35.26 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.954 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -74.61 155.85 37.4 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 0.0 OUTLIER -104.34 153.68 38.86 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.241 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -53.82 -32.91 68.73 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.07 1.847 . . . . 0.0 112.857 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -58.44 -43.02 88.59 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.416 ' HB3' HD21 ' F' ' 22' ' ' LEU . 16.7 mm100 -71.77 -36.96 70.52 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.728 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' F' ' 27' ' ' LEU . 50.6 mt -62.29 -38.66 90.24 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.33 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 1.4 m -66.15 -48.6 70.24 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.49 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -66.84 -54.31 23.76 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.846 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.93 -32.06 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.529 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.34 -47.89 80.26 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 123.405 0.44 . . . . 0.0 109.91 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 15.7 m -71.0 -43.41 68.03 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.228 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.67 HD11 ' HB3' ' C' ' 30' ' ' ALA . 4.6 tp -55.32 -44.36 75.75 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.058 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -80.43 -51.61 8.63 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.028 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -58.28 -35.25 71.53 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.279 0.362 . . . . 0.0 111.914 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -129.22 84.13 63.47 Favored Pre-proline 0 CA--C 1.539 0.547 0 O-C-N 123.272 0.357 . . . . 0.0 110.515 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.79 -32.94 79.06 Favored 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 122.667 2.245 . . . . 0.0 112.351 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 99.8 p -65.68 -32.52 74.12 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.095 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.36 -15.77 45.25 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.482 ' HB2' HD12 ' F' ' 34' ' ' LEU . 97.0 p -47.59 -44.35 26.3 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -177.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.19 70.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.76 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -64.07 -39.45 94.1 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 39.0 mt -63.43 -33.84 76.43 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.779 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -40.19 95.13 Favored 'General case' 0 N--CA 1.461 0.104 0 O-C-N 123.542 0.526 . . . . 0.0 109.749 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.75 -50.39 67.04 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.638 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -67.43 -43.13 81.94 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.815 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.04 87.01 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -64.66 -36.44 84.27 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.384 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.32 -33.99 75.31 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -65.16 -38.87 91.92 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.316 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.36 -39.01 81.87 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 177.681 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -73.81 -32.14 63.59 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.548 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.84 -34.66 60.1 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.696 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -96.28 -2.35 46.14 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.742 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.599 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.401 ' CD ' HG23 ' C' ' 18' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.463 0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.773 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' C' ' 17' ' ' LEU . 4.0 mm? -112.89 128.32 56.43 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.215 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.401 HG23 ' CD ' ' C' ' 16' ' ' LYS . 98.4 t -127.67 135.15 63.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.626 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.839 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -102.89 129.09 49.48 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.234 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.0 p90 -139.87 154.96 47.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.353 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.37 132.05 55.1 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.56 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.404 ' OE2' HD12 ' C' ' 31' ' ' ILE . 3.5 pt-20 -107.2 136.01 47.77 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.359 0.412 . . . . 0.0 110.504 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -77.32 114.9 16.62 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.542 HG11 HG13 ' C' ' 31' ' ' ILE . 13.6 m -123.59 -12.5 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.252 -177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.59 -122.6 30.5 Favored Glycine 0 C--N 1.339 0.716 0 N-CA-C 108.957 -1.657 . . . . 0.0 108.957 -178.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m 48.47 28.79 1.82 Allowed 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 25.0 t30 68.36 1.63 2.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.927 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -97.06 -6.53 34.99 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.401 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.06 -97.24 0.25 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -132.32 163.04 29.53 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.542 HG13 HG11 ' C' ' 24' ' ' VAL . 4.0 mt -112.05 132.78 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.399 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.471 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -81.38 116.48 25.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.5 146.53 18.42 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.572 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 155.68 37.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.475 0.655 . . . . 0.0 111.698 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.4 mtp -104.71 136.07 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.166 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -115.2 123.55 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 O-C-N 123.811 0.695 . . . . 0.0 111.368 -178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 48.12 75.4 0.19 Allowed Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.269 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -144.7 -150.66 5.27 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 14.4 p -134.04 143.78 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 115.462 -0.369 . . . . 0.0 110.421 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.236 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.706 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -97.79 128.39 44.4 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -106.07 125.78 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 109.907 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.483 HG21 HD11 ' E' ' 45' ' ' LEU . 52.0 t -107.84 145.96 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.686 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -128.43 124.34 35.99 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.28 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 17.5 mt -121.1 62.78 11.41 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.24 -26.15 30.32 Favored 'Trans proline' 0 N--CA 1.501 1.942 0 C-N-CA 123.012 2.475 . . . . 0.0 112.743 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -90.28 4.75 49.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.124 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -92.08 129.57 38.0 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.512 ' H ' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -67.33 157.08 86.67 Favored Pre-proline 0 C--O 1.236 0.378 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.675 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_exo -52.44 -33.88 58.94 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.125 1.884 . . . . 0.0 111.842 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -64.51 -46.66 81.97 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.021 178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -64.19 -44.99 90.31 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.68 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.15 -37.21 84.34 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 9.4 t -67.34 -44.89 77.94 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.798 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.52 -45.39 94.0 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.108 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.785 ' CE2' HD11 ' E' ' 34' ' ' LEU . 62.9 t80 -66.32 -51.17 59.99 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 114.528 -1.214 . . . . 0.0 110.964 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.839 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.3 mt -56.46 -39.74 63.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.05 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -68.68 -38.7 80.55 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 65.5 m -62.86 -46.18 89.12 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.768 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.785 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.0 mt -60.77 -44.31 96.91 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.392 0.615 . . . . 0.0 109.999 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -67.18 -49.63 63.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.908 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -62.83 -40.69 98.19 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 121.402 -0.119 . . . . 0.0 111.209 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -131.27 81.57 65.23 Favored Pre-proline 0 N--CA 1.471 0.595 0 O-C-N 123.284 0.365 . . . . 0.0 110.624 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.74 -26.8 18.91 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.514 2.142 . . . . 0.0 112.197 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 55.9 p -62.4 -36.98 84.05 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -92.78 8.27 40.14 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.056 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.402 ' HB2' HD23 ' C' ' 17' ' ' LEU . 91.6 p -51.76 -38.17 54.34 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -178.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.54 -47.59 78.23 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.7 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 19.9 m120 -66.13 -46.71 76.58 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.505 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 mt -56.85 -41.51 78.06 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.989 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.609 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.5 OUTLIER -59.97 -43.85 94.83 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -50.73 -35.94 33.87 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.638 0.587 . . . . 0.0 110.175 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.9 -38.18 73.0 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.652 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.18 -30.15 66.06 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.5 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.609 ' CE ' HD22 ' E' ' 45' ' ' LEU . 18.7 mttt -67.22 -39.63 86.29 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -60.79 -37.83 83.26 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.519 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 1.2 mm? -66.57 -39.27 88.39 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.309 177.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 15.5 t-20 -55.7 -40.36 72.28 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -79.65 -33.93 40.86 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.48 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.519 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.4 -32.46 73.86 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.512 HE22 ' H ' ' E' ' 23' ' ' ASN . 18.5 mt-30 -112.04 2.36 16.8 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.356 0.41 . . . . 0.0 111.208 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.199 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.643 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -67.55 141.86 56.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.5 mt -116.86 141.11 36.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.478 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 t -119.8 115.81 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.619 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.2 m-85 -94.99 133.46 38.73 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.413 0.445 . . . . 0.0 109.925 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.79 78.6 48.97 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.575 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -87.83 -45.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.144 2.563 . . . . 0.0 113.018 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 5.49 28.57 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.99 152.07 26.87 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -81.21 150.63 68.35 Favored Pre-proline 0 N--CA 1.465 0.31 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.17 -31.37 75.02 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 121.506 1.471 . . . . 0.0 110.609 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.1 -41.59 97.23 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -65.83 -36.64 84.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.375 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.1 mt -65.72 -42.04 91.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.6 t -61.39 -48.63 80.37 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.962 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.71 -39.82 95.24 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.673 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.563 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.4 t80 -62.13 -54.08 46.32 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.541 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.422 HD11 HD11 ' E' ' 31' ' ' ILE . 97.5 mt -59.95 -37.51 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 O-C-N 123.377 0.423 . . . . 0.0 110.94 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -61.51 -39.26 90.35 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.2 m -67.42 -40.68 85.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.08 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.563 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.5 mt -58.65 -44.78 90.2 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.9 0.381 . . . . 0.0 110.013 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.95 -38.07 76.04 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.335 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.48 -39.42 70.4 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.33 0.394 . . . . 0.0 111.753 -178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -155.6 112.21 2.21 Favored Pre-proline 0 CA--C 1.54 0.559 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.61 -38.97 94.44 Favored 'Trans proline' 0 N--CA 1.501 1.938 0 C-N-CA 122.516 2.144 . . . . 0.0 113.222 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 12.1 m -63.41 -40.67 97.82 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.627 0.251 . . . . 0.0 111.071 -179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.12 -23.94 67.28 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -47.25 -40.52 16.71 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 117.793 0.27 . . . . 0.0 111.722 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.6 -51.65 66.5 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -64.0 -39.34 93.9 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 48.9 mt -63.04 -36.89 85.09 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.546 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -38.67 87.26 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.028 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.1 -53.28 56.04 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.998 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -67.35 -40.75 85.84 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.705 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -44.62 97.1 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.262 0.554 . . . . 0.0 109.642 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttmm -65.89 -36.96 84.87 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.912 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -63.66 -37.39 87.14 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.879 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.7 mt -62.73 -40.83 98.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.65 -36.1 69.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.8 -38.44 38.3 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.507 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.77 -33.29 73.63 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.56 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -94.2 -11.2 30.82 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.735 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.378 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.883 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt . . . . . 0 C--O 1.236 0.357 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.5 mm? -109.39 129.49 55.53 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -128.6 135.62 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.55 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.891 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -103.51 129.72 50.75 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 179.142 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.491 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.5 p90 -139.11 155.47 47.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.944 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.07 131.24 57.0 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.403 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -102.99 126.71 50.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.471 0.482 . . . . 0.0 109.974 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -75.12 116.28 15.68 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.516 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.9 m -122.26 -5.13 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.437 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.94 -117.51 7.54 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 16.8 p 38.0 35.73 0.09 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 178.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 63.68 2.1 1.21 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.181 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -97.39 -6.09 34.87 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.338 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.56 -103.35 1.02 Allowed Glycine 0 C--N 1.337 0.634 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 -178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.8 164.46 22.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.579 0.228 . . . . 0.0 110.461 178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.516 ' CD1' HG11 ' C' ' 24' ' ' VAL . 54.0 mt -114.98 135.38 55.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.158 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 2.0 mm -84.26 116.46 28.07 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 121.239 0.543 . . . . 0.0 109.648 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.71 147.01 19.0 Favored Glycine 0 CA--C 1.517 0.182 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 178.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.53 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -123.94 157.1 35.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.414 0.626 . . . . 0.0 111.593 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.505 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 7.8 mtp -105.83 138.79 41.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.301 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 9.2 t -119.37 130.68 73.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.634 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.86 33.97 75.87 Favored Glycine 0 C--N 1.342 0.914 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -91.67 -173.58 42.83 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-O 121.778 0.654 . . . . 0.0 112.657 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 20.5 m -137.27 139.4 43.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 113.869 -1.165 . . . . 0.0 109.15 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.222 -0.374 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.051 -179.507 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.948 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.02 123.49 33.95 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mt -108.16 128.44 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 121.091 0.472 . . . . 0.0 110.272 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.4 HG11 HD21 ' E' ' 45' ' ' LEU . 56.2 t -110.96 143.22 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.473 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -125.44 128.37 47.98 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.761 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.514 HD13 HD22 ' E' ' 22' ' ' LEU . 33.6 mt -124.95 53.52 7.75 Favored Pre-proline 0 CA--C 1.545 0.757 0 O-C-N 123.114 0.258 . . . . 0.0 111.615 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.462 ' HB3' HG23 ' C' ' 31' ' ' ILE . 18.5 Cg_endo -62.48 -16.37 51.57 Favored 'Trans proline' 0 N--CA 1.501 1.932 0 C-N-CA 122.306 2.004 . . . . 0.0 111.456 178.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.9 m-20 -88.82 -2.87 58.81 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.357 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.514 HD22 HD13 ' E' ' 19' ' ' LEU . 9.4 mp -97.38 129.0 44.66 Favored 'General case' 0 C--N 1.343 0.315 0 CA-C-O 121.041 0.448 . . . . 0.0 111.562 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -65.39 158.93 70.5 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.475 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -53.34 -35.76 76.05 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.06 1.84 . . . . 0.0 111.534 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.17 -48.13 77.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.992 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -64.06 -43.32 95.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.747 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.1 mt -62.11 -41.92 98.71 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 7.3 t -65.51 -41.91 92.64 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 109.962 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.31 -45.93 92.4 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.075 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.502 ' CE2' HD22 ' E' ' 34' ' ' LEU . 45.8 t80 -65.22 -50.62 65.14 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.606 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.891 HD11 ' CE2' ' C' ' 19' ' ' PHE . 22.0 mt -58.73 -33.1 48.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.567 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -64.7 -50.24 67.76 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.14 0.495 . . . . 0.0 110.251 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 28.7 t -71.77 -40.68 69.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.69 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.545 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.1 tp -57.08 -39.48 75.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.735 -179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -80.66 -46.34 15.76 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.57 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -61.6 -37.94 85.74 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -126.34 82.59 65.66 Favored Pre-proline 0 N--CA 1.47 0.561 0 O-C-N 123.318 0.386 . . . . 0.0 110.668 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.56 -27.64 15.29 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 C-N-CA 122.539 2.16 . . . . 0.0 112.352 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 37.4 p -61.95 -38.82 89.91 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.176 179.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.75 7.58 41.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.307 -0.861 . . . . 0.0 110.935 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -51.53 -36.31 44.39 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.45 -48.18 76.25 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.357 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 8.7 t-20 -65.56 -43.3 90.29 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.799 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.87 -38.97 87.46 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.076 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.635 HD22 ' HG3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -65.62 -36.92 85.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -52.55 -34.76 51.62 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.49 -43.07 57.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.254 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -69.49 -33.91 73.56 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 123.77 0.669 . . . . 0.0 110.387 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.635 ' HG3' HD22 ' E' ' 45' ' ' LEU . 31.6 mtmt -68.64 -45.71 71.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 40.6 mtpt -59.56 -31.96 69.91 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 175.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -69.02 -39.83 79.03 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.734 177.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 46.3 t30 -56.44 -39.44 73.12 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.2 -32.1 43.99 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.202 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.46 68.95 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.877 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -116.58 7.87 13.75 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.066 0.46 . . . . 0.0 110.912 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.606 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.477 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -69.96 145.15 52.07 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.1 mt -116.01 145.09 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.973 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 14.4 t -128.22 122.37 57.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.124 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.505 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 4.9 m-85 -99.05 137.04 38.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 123.499 0.499 . . . . 0.0 110.857 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.602 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -115.59 72.11 3.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.539 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.43 -54.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.758 2.305 . . . . 0.0 113.139 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.85 3.76 36.42 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.602 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -74.57 149.48 40.11 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -79.5 147.72 68.47 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -58.58 -33.0 97.81 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 121.486 1.457 . . . . 0.0 110.659 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.06 -44.16 97.8 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -64.99 -36.13 83.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.204 -1.362 . . . . 0.0 110.331 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' F' ' 27' ' ' LEU . 27.8 mt -63.51 -45.92 88.43 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 t -59.73 -47.89 83.84 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.548 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.94 -38.79 92.37 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.817 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.648 ' CE2' HD11 ' F' ' 34' ' ' LEU . 27.6 t80 -61.67 -52.6 63.66 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.667 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.596 ' HA ' HD12 ' F' ' 34' ' ' LEU . 97.8 mt -59.29 -40.82 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.583 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -60.06 -40.98 91.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.103 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.3 m -66.87 -41.65 86.92 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.338 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.648 HD11 ' CE2' ' F' ' 30' ' ' PHE . 28.2 mt -59.24 -36.77 76.06 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 110.253 -0.276 . . . . 0.0 110.253 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -80.68 -31.97 36.14 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.2 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -59.01 -38.92 80.34 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 121.196 -0.202 . . . . 0.0 110.673 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -152.58 109.75 2.75 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -64.53 -37.22 39.17 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 121.726 1.617 . . . . 0.0 112.87 -178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.2 m -60.36 -36.44 78.02 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.971 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.91 -11.0 59.98 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.09 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.406 ' HA ' HD12 ' F' ' 44' ' ' LEU . 79.1 p -53.14 -39.49 63.56 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 117.677 0.217 . . . . 0.0 111.42 -178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.08 -48.21 82.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.267 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -40.5 95.11 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' F' ' 41' ' ' SER . 40.9 mt -61.94 -35.43 78.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.748 178.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -61.23 -38.35 86.33 Favored 'General case' 0 CA--C 1.523 -0.08 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.183 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.93 -59.08 5.65 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.273 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -62.88 -41.62 99.47 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.101 0.251 . . . . 0.0 111.288 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.67 89.84 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 7.7 ttpp -67.23 -40.83 86.4 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.253 177.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -59.4 -34.65 72.71 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.433 ' HB2' ' CD1' ' F' ' 22' ' ' LEU . 50.3 mt -62.05 -39.26 91.76 Favored 'General case' 0 CA--C 1.513 -0.457 0 O-C-N 123.227 0.33 . . . . 0.0 110.258 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.73 -34.89 69.97 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 179.087 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -80.85 -33.91 34.17 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.102 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.47 -37.22 65.84 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.206 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -93.26 -4.41 51.89 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.916 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.674 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 121.199 0.523 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 4.1 mm? -108.79 133.77 52.4 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.033 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 29.1 t -131.46 130.96 63.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.827 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.22 127.18 46.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.445 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 40.7 p90 -136.46 157.56 46.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.501 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.07 133.46 52.89 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.098 -0.955 . . . . 0.0 108.923 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -104.91 143.13 33.58 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 123.388 0.43 . . . . 0.0 110.65 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -81.36 109.7 16.11 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.49 HG11 HG13 ' C' ' 31' ' ' ILE . 4.5 m -119.97 -14.5 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 116.165 -0.471 . . . . 0.0 112.106 -177.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.0 -125.32 39.02 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 -178.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.2 m 51.21 27.5 3.53 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.65 6.89 4.75 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.747 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -99.57 -6.35 27.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.406 178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.32 -99.88 0.48 Allowed Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.53 160.35 34.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.49 HG13 HG11 ' C' ' 24' ' ' VAL . 30.6 mt -109.31 132.46 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.461 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.8 mm -84.18 116.73 28.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.29 151.02 20.94 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 108.138 -1.985 . . . . 0.0 108.138 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.634 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -128.07 155.27 44.64 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 121.553 0.692 . . . . 0.0 111.348 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.8 ptm -100.9 145.23 28.88 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.172 -1.377 . . . . 0.0 109.105 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 4.9 t -124.23 120.5 59.46 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 123.424 0.452 . . . . 0.0 111.288 -178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 61.46 136.7 0.01 OUTLIER Glycine 0 CA--C 1.529 0.942 0 CA-C-N 115.632 -0.713 . . . . 0.0 114.292 178.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.75 -172.61 55.17 Favored Glycine 0 N--CA 1.468 0.812 0 CA-C-N 114.978 -0.611 . . . . 0.0 112.571 178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 t -128.93 142.41 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.393 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.946 179.632 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.821 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -91.27 131.15 36.97 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -113.0 126.76 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.405 0.621 . . . . 0.0 111.013 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.677 HG21 HD21 ' E' ' 45' ' ' LEU . 64.6 t -105.2 146.35 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 114.359 -1.291 . . . . 0.0 112.208 -178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -127.09 123.61 37.28 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.169 177.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.538 HD13 HD12 ' E' ' 22' ' ' LEU . 38.2 mt -120.47 60.09 7.47 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 123.516 0.51 . . . . 0.0 110.603 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.94 -23.85 40.37 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 122.589 2.192 . . . . 0.0 111.35 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -80.82 -5.59 57.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.184 -0.916 . . . . 0.0 112.187 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.668 HD22 ' HG2' ' E' ' 26' ' ' GLN . 63.0 mt -95.02 133.29 38.96 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.472 0.653 . . . . 0.0 111.327 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' E' ' 26' ' ' GLN . 1.1 p-10 -72.61 160.66 82.26 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 114.418 -1.265 . . . . 0.0 109.329 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.2 -31.62 46.69 Favored 'Trans proline' 0 N--CA 1.495 1.574 0 C-N-CA 122.017 1.811 . . . . 0.0 112.213 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.23 -45.13 77.68 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.324 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.668 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.5 tp-100 -67.95 -43.05 79.95 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.951 -0.3 . . . . 0.0 110.721 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . 0.473 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.9 mt -62.28 -43.92 97.71 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 17.0 t -63.2 -45.27 92.53 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.244 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.95 -45.93 92.73 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.542 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.511 ' CE2' HD22 ' E' ' 34' ' ' LEU . 41.7 t80 -65.39 -49.34 69.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.893 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.827 HD11 ' CE2' ' C' ' 19' ' ' PHE . 43.3 mt -57.94 -38.37 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -66.43 -49.98 64.91 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.241 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -65.75 -41.17 92.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.511 HD22 ' CE2' ' E' ' 30' ' ' PHE . 31.9 tp -57.73 -39.61 77.72 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.385 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -80.12 -47.41 14.81 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.351 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -58.76 -39.13 80.07 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.342 0.401 . . . . 0.0 111.927 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -125.04 82.72 61.24 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 123.23 0.331 . . . . 0.0 110.494 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.52 -25.84 14.7 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 122.472 2.115 . . . . 0.0 112.062 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 46.0 t -58.81 -38.02 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.549 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -100.91 15.77 27.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.726 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.5 p -50.2 -35.01 24.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.7 -47.22 63.94 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.908 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -62.82 -49.43 74.94 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.048 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 78.9 mt -58.7 -45.38 89.62 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.526 0.516 . . . . 0.0 110.515 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.677 HD21 HG21 ' E' ' 17' ' ' VAL . 10.6 tp -62.21 -36.02 80.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.111 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.72 67.1 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -75.32 -40.39 58.49 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.921 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -65.4 -28.54 69.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.583 ' HE3' HD11 ' E' ' 45' ' ' LEU . 46.2 mttt -73.23 -39.51 65.42 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -62.99 -30.71 71.8 Favored 'General case' 0 C--N 1.346 0.456 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.45 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -72.42 -41.61 66.02 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.177 178.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -55.87 -38.82 70.63 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.553 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.4 t70 -79.48 -31.93 42.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.308 -1.315 . . . . 0.0 110.384 178.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.19 -23.6 67.37 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.304 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -123.29 7.05 9.06 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.031 0.443 . . . . 0.0 110.606 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.553 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.776 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -64.39 143.8 57.63 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.3 mt -116.97 142.91 28.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.975 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.6 t -125.47 116.28 46.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.692 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.445 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -96.07 134.2 39.4 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.516 0.51 . . . . 0.0 110.406 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.4 HD22 HD13 ' F' ' 22' ' ' LEU . 15.1 mt -123.41 77.24 54.05 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.786 -178.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -85.62 -60.64 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.883 2.389 . . . . 0.0 112.071 179.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.27 -25.88 66.04 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.539 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.4 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -52.66 149.53 5.96 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.424 0.452 . . . . 0.0 110.671 -179.816 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -88.76 146.96 38.09 Favored Pre-proline 0 N--CA 1.465 0.308 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.41 -36.36 97.28 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.909 1.739 . . . . 0.0 112.4 -178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -61.08 -38.65 86.98 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.476 ' HG2' HD23 ' F' ' 51' ' ' LEU . 67.0 tp60 -67.49 -39.34 85.22 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.578 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.33 -39.15 86.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.93 -45.74 91.07 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.24 97.23 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.747 178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.582 ' CE2' HD11 ' F' ' 34' ' ' LEU . 33.7 t80 -61.01 -54.11 48.98 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.824 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 96.2 mt -59.99 -37.98 74.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 123.338 0.399 . . . . 0.0 110.811 -179.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.72 -40.66 93.13 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.1 m -65.77 -40.95 92.53 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.088 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.582 HD11 ' CE2' ' F' ' 30' ' ' PHE . 83.3 mt -58.81 -41.65 87.29 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -73.01 -33.89 66.04 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -54.84 -39.8 68.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.229 0.331 . . . . 0.0 111.724 -178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -159.67 115.81 1.54 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 123.289 0.368 . . . . 0.0 110.258 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.44 -39.83 85.95 Favored 'Trans proline' 0 N--CA 1.5 1.858 0 C-N-CA 122.455 2.103 . . . . 0.0 113.26 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.0 p -63.28 -36.38 83.48 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.466 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -69.21 -24.66 64.05 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 62.0 p -47.7 -42.37 24.88 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.85 -50.66 72.53 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.361 0.413 . . . . 0.0 110.826 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -63.95 -42.6 97.25 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 120.898 0.38 . . . . 0.0 110.132 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 38.2 mt -61.26 -34.33 74.99 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.788 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.46 -39.05 92.14 Favored 'General case' 0 C--O 1.228 -0.07 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.666 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.38 -54.41 37.23 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.215 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -62.42 -44.84 95.45 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.067 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.68 90.93 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.252 0.549 . . . . 0.0 110.148 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -69.0 -34.43 75.27 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.178 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -72.31 -34.92 68.46 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.476 HD23 ' HG2' ' F' ' 26' ' ' GLN . 13.7 tp -64.81 -39.57 93.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.261 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.3 OUTLIER -59.08 -38.74 80.19 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -73.22 -35.19 66.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.08 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.04 -35.33 74.22 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 -179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -93.88 -8.58 39.91 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.328 0.393 . . . . 0.0 110.715 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.395 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.582 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 121.201 0.524 . . . . 0.0 111.681 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.534 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -125.18 146.22 49.6 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.382 -0.826 . . . . 0.0 108.874 178.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.46 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.8 t -140.02 139.54 36.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.649 -178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -105.49 127.91 53.27 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.56 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.441 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.1 p90 -139.86 156.95 46.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.853 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.52 137.75 51.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.246 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.481 ' O ' HG13 ' C' ' 24' ' ' VAL . 36.5 tt0 -108.59 118.85 37.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -68.43 128.57 37.09 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.634 HG11 ' CG1' ' C' ' 31' ' ' ILE . 18.1 m -116.82 2.0 7.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -176.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.97 -46.04 0.73 Allowed Glycine 0 CA--C 1.533 1.159 0 O-C-N 123.189 0.306 . . . . 0.0 113.082 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 36.1 m -56.83 167.78 0.73 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.018 0.437 . . . . 0.0 111.481 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -52.98 -24.54 9.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.751 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -56.74 -28.55 61.28 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.1 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . 0.562 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.07 -94.29 1.98 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -137.33 164.31 28.89 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 110.389 -0.226 . . . . 0.0 110.389 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.634 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.8 OUTLIER -113.64 135.68 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.44 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.6 mm -85.0 122.43 38.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.38 154.83 25.73 Favored Glycine 0 N--CA 1.454 -0.154 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.615 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -130.11 155.94 45.36 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.509 0.671 . . . . 0.0 111.521 -179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.46 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.0 ptm -101.24 145.57 28.67 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.699 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.44 119.2 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 123.31 0.381 . . . . 0.0 111.593 -178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.57 143.14 0.03 OUTLIER Glycine 0 CA--C 1.529 0.939 0 O-C-N 123.763 0.664 . . . . 0.0 114.32 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.57 178.37 7.58 Favored Glycine 0 N--CA 1.467 0.76 0 CA-C-N 114.947 -0.627 . . . . 0.0 112.508 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 46.2 t -116.33 136.81 52.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.159 -0.521 . . . . 0.0 109.868 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 p . . . . . 0 CA--C 1.537 0.477 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.774 179.579 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -93.75 122.56 36.34 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.5 mt -106.57 127.65 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.507 0.67 . . . . 0.0 111.307 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 56.2 t -105.81 145.96 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.301 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -128.26 126.56 41.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.916 177.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.49 HD13 HD22 ' E' ' 22' ' ' LEU . 19.6 mt -122.05 56.73 7.51 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-O 120.742 0.305 . . . . 0.0 110.656 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.92 -15.83 50.03 Favored 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.293 1.995 . . . . 0.0 111.432 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 19.6 m-20 -86.43 -6.52 58.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.845 -178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.49 HD22 HD13 ' E' ' 19' ' ' LEU . 9.8 mp -95.54 135.06 37.67 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-O 121.111 0.482 . . . . 0.0 111.494 -179.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -76.2 162.91 69.6 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.569 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.73 -34.4 64.34 Favored 'Trans proline' 0 N--CA 1.502 2.007 0 C-N-CA 121.999 1.799 . . . . 0.0 111.572 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -63.95 -48.25 77.25 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.741 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -64.77 -46.09 83.61 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.66 -43.67 98.23 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.257 0.348 . . . . 0.0 110.151 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -63.57 -43.04 98.17 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.162 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.64 -45.96 90.43 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.239 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.58 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 36.6 t80 -62.47 -51.12 68.74 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.302 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 70.3 mt -59.28 -34.97 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.059 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -65.89 -50.57 64.03 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.4 t -68.22 -41.9 80.59 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.145 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.534 HD21 HD22 ' C' ' 17' ' ' LEU . 40.6 tp -57.3 -41.35 79.69 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.573 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -72.6 -38.95 67.66 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.389 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -59.55 -41.31 89.82 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.2 86.73 50.04 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.31 -29.41 46.38 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 122.049 1.832 . . . . 0.0 111.234 179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 40.4 t -61.73 -38.08 86.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.035 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -93.33 9.24 37.15 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.823 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.499 ' OG ' HD11 ' E' ' 34' ' ' LEU . 28.4 t -51.79 -40.6 60.66 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.73 -47.72 82.34 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 123.185 0.303 . . . . 0.0 110.629 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -65.73 -45.87 81.05 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.383 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.5 -37.95 79.64 Favored 'General case' 0 C--O 1.234 0.268 0 O-C-N 123.729 0.643 . . . . 0.0 110.518 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.722 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.4 OUTLIER -64.41 -37.42 87.46 Favored 'General case' 0 CA--C 1.523 -0.068 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.887 179.42 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.1 -33.07 64.75 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.471 0.482 . . . . 0.0 109.766 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -74.21 -40.57 62.38 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.294 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.58 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -71.48 -31.5 67.2 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.722 ' HE3' HD22 ' E' ' 45' ' ' LEU . 86.9 mttt -72.11 -38.9 69.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.08 -32.17 72.68 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 175.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.6 OUTLIER -71.69 -40.87 69.24 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 114.966 -1.016 . . . . 0.0 108.356 176.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.63 -37.64 71.0 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -79.51 -35.37 40.19 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.507 177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.54 -34.06 77.36 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.647 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -89.62 -69.87 0.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.582 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.545 0.752 0 CA-C-N 114.419 -1.264 . . . . 0.0 114.111 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.75 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -69.96 147.38 50.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.366 -0.417 . . . . 0.0 110.182 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 86.2 mt -116.17 142.36 29.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.13 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 t -126.62 119.28 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.196 -179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.441 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -96.64 137.3 35.93 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.607 0.567 . . . . 0.0 110.667 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.694 HD12 HD13 ' F' ' 22' ' ' LEU . 2.3 mm? -117.7 71.06 7.24 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.925 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.09 -54.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 122.759 2.306 . . . . 0.0 113.072 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -83.94 6.95 19.87 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.098 -178.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.694 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.9 148.21 34.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.513 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 61.6 m-80 -76.08 141.12 70.58 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.65 -39.04 90.75 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.718 1.612 . . . . 0.0 111.537 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -62.88 -40.54 97.82 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.57 ' HG2' HD13 ' F' ' 51' ' ' LEU . 52.1 tp60 -63.84 -36.65 84.61 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.983 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.82 -43.55 92.73 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.126 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 36.4 t -61.69 -46.45 89.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.926 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.92 85.44 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.612 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.686 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -61.49 -52.7 63.44 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.69 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' F' ' 34' ' ' LEU . 93.4 mt -58.92 -40.42 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 O-C-N 123.34 0.4 . . . . 0.0 111.034 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -62.12 -39.27 91.96 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.1 m -64.73 -40.33 95.15 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.802 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.686 HD11 ' CE2' ' F' ' 30' ' ' PHE . 49.2 mt -62.06 -39.35 92.11 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -72.94 -53.19 11.9 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.371 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.78 -36.69 79.62 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.818 -178.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -128.09 79.45 73.85 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 123.347 0.404 . . . . 0.0 110.375 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -58.4 -50.34 9.9 Favored 'Trans proline' 0 N--CA 1.501 1.958 0 C-N-CA 122.831 2.354 . . . . 0.0 112.627 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 23.1 m -61.43 -33.91 74.51 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.705 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -84.95 -1.32 56.55 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.62 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.467 ' HA ' HD12 ' F' ' 44' ' ' LEU . 92.8 p -54.47 -38.7 66.7 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.73 0.3 . . . . 0.0 110.933 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.9 87.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.872 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -64.45 -40.55 95.94 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' F' ' 41' ' ' SER . 52.4 mt -62.6 -36.44 82.74 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.539 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.2 mp -61.54 -39.19 90.18 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.203 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.05 -52.54 63.53 Favored 'General case' 0 C--O 1.233 0.236 0 O-C-N 123.342 0.401 . . . . 0.0 111.0 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -70.3 -39.44 74.84 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.924 -0.31 . . . . 0.0 110.844 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.98 -42.34 98.16 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 4.8 ttmm -66.16 -38.33 87.8 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.599 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.99 -36.31 81.13 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.989 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' F' ' 26' ' ' GLN . 33.0 mt -61.56 -39.18 90.18 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.07 -37.46 71.87 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -78.32 -36.53 46.26 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.716 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' F' ' 51' ' ' LEU . . . -73.15 -31.5 64.3 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.945 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -99.1 -3.14 35.28 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.783 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.503 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.37 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.574 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.452 0.168 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.578 HD13 ' O ' ' C' ' 35' ' ' MET . 3.7 mm? -100.97 134.32 44.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.961 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 37.2 t -129.34 130.3 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.849 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -101.03 125.35 47.64 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.446 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 33.9 p90 -135.97 155.87 49.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.318 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.17 135.24 54.09 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.834 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -107.61 126.3 52.39 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -76.68 112.79 13.62 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.523 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.6 m -117.27 -11.35 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.197 -177.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.45 -122.43 29.83 Favored Glycine 0 C--N 1.34 0.757 0 N-CA-C 109.032 -1.627 . . . . 0.0 109.032 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.3 m 47.07 28.5 0.92 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 69.94 -5.38 1.27 Allowed 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.156 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -89.77 -4.48 57.64 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.307 178.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.04 -106.6 1.63 Allowed Glycine 0 C--N 1.337 0.592 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.56 164.58 19.5 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.679 0.276 . . . . 0.0 110.508 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' E' ' 20' ' ' PRO . 52.1 mt -114.13 135.89 52.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.247 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.1 mm -85.26 116.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.67 178.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.5 145.28 17.32 Favored Glycine 0 N--CA 1.452 -0.251 0 N-CA-C 108.31 -1.916 . . . . 0.0 108.31 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.539 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -123.61 160.02 28.01 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.555 0.693 . . . . 0.0 111.516 -179.528 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.578 ' O ' HD13 ' C' ' 17' ' ' LEU . 0.0 OUTLIER -107.79 144.2 35.29 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.912 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.59 124.08 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.711 0.632 . . . . 0.0 110.823 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.99 133.23 0.31 Allowed Glycine 0 CA--C 1.527 0.842 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.867 178.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 60.75 -172.15 6.66 Favored Glycine 0 C--N 1.336 0.577 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.77 146.86 24.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.227 -0.486 . . . . 0.0 111.02 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 90.0 t . . . . . 0 CA--C 1.541 0.634 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.41 179.544 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.988 0 N-CA-C 111.561 -0.616 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.81 123.87 47.87 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -102.05 124.81 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 121.311 0.577 . . . . 0.0 110.72 -179.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.555 HG21 HD21 ' E' ' 45' ' ' LEU . 53.5 t -111.01 145.51 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.032 -178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -124.43 125.84 44.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.284 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 39.8 mt -121.73 59.84 10.46 Favored Pre-proline 0 CA--C 1.543 0.711 0 O-C-N 123.269 0.356 . . . . 0.0 110.788 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.53 ' HB3' HG23 ' C' ' 31' ' ' ILE . 55.4 Cg_endo -70.75 -21.72 28.51 Favored 'Trans proline' 0 N--CA 1.502 1.991 0 C-N-CA 122.76 2.307 . . . . 0.0 111.489 178.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 72.8 m-20 -84.38 -6.95 59.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.32 -178.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -92.22 143.81 26.04 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.786 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.433 ' ND2' HE22 ' E' ' 55' ' ' GLN . 5.3 p30 -84.53 162.18 51.57 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.725 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.15 -37.17 68.98 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.176 1.918 . . . . 0.0 112.516 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -63.33 -44.65 94.3 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -67.08 -45.86 76.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.425 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.3 mt -63.23 -40.15 96.64 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -67.18 -42.01 84.93 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.22 -45.59 93.94 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.975 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.647 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 33.3 t80 -66.89 -49.7 64.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.784 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.849 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.1 mt -57.91 -39.65 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -64.53 -50.19 68.34 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.366 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -66.81 -43.0 85.0 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.4 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.647 HD22 ' CZ ' ' E' ' 30' ' ' PHE . 46.5 tp -57.64 -39.25 76.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.835 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -82.1 -47.17 12.89 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.904 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -59.95 -36.63 77.51 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -128.5 79.77 73.64 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-O 120.838 0.351 . . . . 0.0 111.044 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -61.67 -26.58 80.27 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.364 2.042 . . . . 0.0 112.234 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -60.98 -38.61 86.6 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.659 -0.246 . . . . 0.0 110.367 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -92.31 11.84 24.54 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.122 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.3 p -54.07 -41.65 68.42 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.48 -47.58 72.59 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.583 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -63.82 -50.76 67.65 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.856 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.41 -46.76 80.03 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.682 0.614 . . . . 0.0 111.061 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.555 HD21 HG21 ' E' ' 17' ' ' VAL . 17.1 tp -63.03 -35.81 81.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.307 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -36.52 69.08 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -72.78 -37.93 67.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.222 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.425 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.63 -32.0 72.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -66.93 -40.27 87.57 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 177.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -62.16 -36.03 80.59 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 176.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.468 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.13 -38.91 92.14 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.053 177.625 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 39.8 t30 -54.95 -40.62 70.15 Favored 'General case' 0 C--N 1.345 0.391 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -80.37 -31.61 37.83 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.623 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.468 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.03 -30.85 71.46 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.078 -178.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.433 HE22 ' ND2' ' E' ' 23' ' ' ASN . 16.7 mt-30 -116.35 7.15 13.85 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.036 0.446 . . . . 0.0 110.839 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.087 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.456 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -92.13 136.08 33.47 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.4 mt -116.08 144.56 23.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.625 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 11.4 t -128.57 115.6 38.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.177 -178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.446 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -93.25 131.44 38.35 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 123.46 0.475 . . . . 0.0 110.238 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mt -123.43 82.99 52.82 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.046 -178.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -87.7 -58.09 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 123.002 2.468 . . . . 0.0 112.314 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -59.95 -26.42 65.96 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.868 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.61 145.65 14.76 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 122.622 0.369 . . . . 0.0 111.653 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -77.31 148.9 78.34 Favored Pre-proline 0 C--O 1.235 0.301 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -61.47 -37.67 69.22 Favored 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 121.486 1.457 . . . . 0.0 111.121 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -62.3 -38.89 91.12 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.486 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.7 tp-100 -63.79 -38.85 92.62 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.514 178.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 41.5 mt -61.75 -40.82 96.48 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.17 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 20.9 t -60.54 -46.85 88.67 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.657 0.265 . . . . 0.0 110.342 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.1 -39.55 94.3 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.762 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.608 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.9 t80 -62.75 -53.89 47.41 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.511 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.8 mt -58.35 -40.36 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 O-C-N 123.442 0.464 . . . . 0.0 110.852 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -60.93 -39.49 89.61 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -65.31 -43.47 90.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.78 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.608 HD11 ' CE2' ' F' ' 30' ' ' PHE . 75.0 mt -58.72 -45.13 90.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.825 0.345 . . . . 0.0 110.181 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -69.95 -49.27 53.47 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.529 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -58.93 -39.63 82.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.812 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.45 86.09 24.53 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 123.27 0.356 . . . . 0.0 110.726 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.44 -38.15 95.15 Favored 'Trans proline' 0 N--CA 1.498 1.791 0 C-N-CA 122.484 2.122 . . . . 0.0 111.814 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 29.5 m -60.74 -36.13 78.11 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.438 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -79.87 -11.28 59.82 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.374 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 96.6 p -48.4 -44.85 35.25 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 117.995 0.361 . . . . 0.0 111.935 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.78 -50.5 73.2 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.959 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -64.14 -39.37 93.88 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.988 0.423 . . . . 0.0 110.152 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.24 -34.82 78.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.862 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.32 -39.45 93.06 Favored 'General case' 0 C--O 1.228 -0.038 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.766 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -50.1 70.28 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.07 -40.19 82.8 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.321 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.79 84.69 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -64.13 -34.4 77.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -71.19 -35.44 71.57 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.486 HD23 ' HG2' ' F' ' 26' ' ' GLN . 11.6 tp -63.91 -38.7 92.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.397 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -37.61 77.26 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -74.1 -36.91 64.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.132 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.4 71.73 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.644 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -96.78 -3.13 42.85 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.817 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.254 -179.555 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.744 HD22 HD21 ' E' ' 34' ' ' LEU . 0.0 OUTLIER -99.38 148.39 24.24 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.321 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.428 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 20.9 t -136.93 134.96 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.693 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.83 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -103.07 125.02 49.61 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.448 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.7 p90 -135.76 158.22 44.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.552 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.5 131.63 56.68 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.487 178.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -103.68 131.54 50.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.238 -179.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.73 115.78 18.65 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.489 HG11 ' CD1' ' C' ' 31' ' ' ILE . 10.0 m -122.42 -17.08 5.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -177.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.21 -126.12 33.1 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 23.0 t 50.34 26.6 2.33 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 65.76 6.96 4.21 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.673 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -97.65 -4.33 37.63 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.079 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.98 -106.34 1.62 Allowed Glycine 0 C--N 1.338 0.674 0 N-CA-C 108.7 -1.76 . . . . 0.0 108.7 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -126.82 164.75 20.69 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.546 HG23 ' HB3' ' E' ' 20' ' ' PRO . 47.7 mt -114.2 134.59 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.17 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.01 115.37 26.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.623 178.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.77 146.43 18.43 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.612 -1.795 . . . . 0.0 108.612 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.665 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.34 159.05 32.71 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.19 0.519 . . . . 0.0 111.204 -179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.428 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 3.9 ptm -106.84 146.16 31.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.723 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.416 HG21 ' CD1' ' E' ' 45' ' ' LEU . 15.1 t -126.7 122.25 60.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 O-C-N 123.492 0.495 . . . . 0.0 111.337 -179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.14 122.11 2.92 Favored Glycine 0 N--CA 1.469 0.884 0 CA-C-N 116.313 -0.403 . . . . 0.0 113.175 177.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 54.4 -158.25 5.88 Favored Glycine 0 C--N 1.346 1.132 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 7.6 p -140.33 144.31 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.655 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.718 179.313 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.844 0 N-CA-C 111.975 -0.45 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -94.19 121.13 35.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -101.66 126.58 55.54 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 121.444 0.64 . . . . 0.0 111.104 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 43.1 t -108.46 144.07 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.961 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -124.15 126.99 47.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 21.0 mt -122.9 53.0 4.78 Favored Pre-proline 0 CA--C 1.545 0.783 0 O-C-N 123.18 0.3 . . . . 0.0 111.804 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.546 ' HB3' HG23 ' C' ' 31' ' ' ILE . 20.2 Cg_endo -64.06 -26.29 65.81 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.091 1.86 . . . . 0.0 110.499 178.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.572 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 36.9 m-20 -66.89 -26.85 67.08 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.086 -179.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.474 ' N ' HD12 ' E' ' 22' ' ' LEU . 10.8 mp -83.72 153.36 24.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.943 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -103.97 169.24 7.53 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.629 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -51.07 -33.52 43.51 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.866 1.711 . . . . 0.0 112.725 -178.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -66.06 -49.29 68.18 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.764 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.46 ' NE2' HD11 ' E' ' 51' ' ' LEU . 22.2 mm100 -66.96 -45.47 77.64 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.468 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . 0.45 HD21 ' HB2' ' E' ' 22' ' ' LEU . 98.7 mt -64.31 -42.34 96.38 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 46.6 t -64.12 -42.99 96.64 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.678 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.1 95.03 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.052 0.453 . . . . 0.0 109.852 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.503 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 35.9 t80 -64.35 -50.79 66.35 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.681 179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.83 HD11 ' CE2' ' C' ' 19' ' ' PHE . 61.1 mt -59.49 -35.15 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.415 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -67.48 -50.25 59.88 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.113 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 33.2 t -66.01 -43.83 86.52 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.844 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.744 HD21 HD22 ' C' ' 17' ' ' LEU . 60.2 tp -52.02 -43.29 63.64 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.267 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -80.71 -33.97 34.92 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.399 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -60.9 -38.21 84.92 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -134.34 80.47 52.14 Favored Pre-proline 0 N--CA 1.472 0.637 0 O-C-N 123.164 0.29 . . . . 0.0 111.093 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -60.62 -24.71 79.13 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 122.588 2.192 . . . . 0.0 112.294 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 43.0 t -57.31 -42.04 81.05 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.959 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -99.52 18.1 18.73 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.878 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.1 p -48.48 -37.36 17.21 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.18 -47.29 65.31 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -62.42 -45.09 94.69 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.72 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 88.8 mt -60.37 -39.18 86.28 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.546 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -63.82 -38.39 90.92 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.445 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.15 -36.49 63.39 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -68.21 -40.2 82.2 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.893 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.31 -33.89 70.11 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.538 -179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.546 ' CE ' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -66.72 -43.12 85.09 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.478 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -63.62 -33.81 76.44 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.506 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -65.57 -38.79 90.58 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.64 177.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -55.46 -39.89 70.93 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 115.278 -0.874 . . . . 0.0 108.946 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -81.15 -32.35 33.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.31 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -63.65 -33.83 76.49 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.705 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -91.0 -68.86 0.76 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.572 ' HA ' ' ND2' ' E' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 114.263 -1.335 . . . . 0.0 114.252 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 111.479 -0.648 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -64.63 143.36 57.98 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 90.7 mt -117.62 141.85 34.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.813 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 t -123.71 114.74 42.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.495 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.448 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.5 m-85 -92.92 136.07 33.58 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.461 0.476 . . . . 0.0 110.25 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.487 HD22 HD13 ' F' ' 22' ' ' LEU . 10.2 mt -123.27 80.33 52.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.285 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -84.54 -53.89 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.134 2.556 . . . . 0.0 113.228 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -78.67 2.78 18.37 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.487 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -77.89 139.75 39.26 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 -179.624 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -73.97 149.21 87.46 Favored Pre-proline 0 N--CA 1.464 0.273 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -63.32 -35.4 62.45 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 C-N-CA 121.668 1.578 . . . . 0.0 110.936 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -61.9 -37.18 83.65 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 33.9 tp60 -65.25 -38.92 91.84 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.041 -0.982 . . . . 0.0 109.416 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.49 -39.76 94.52 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.623 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 66.3 m -61.47 -44.83 96.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.124 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.56 -40.0 92.34 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.68 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -63.52 -54.43 36.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.73 -40.92 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 O-C-N 123.487 0.492 . . . . 0.0 110.864 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -58.21 -39.48 79.12 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.0 m -65.41 -38.63 90.53 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.025 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . . . . . . . . . 66.0 mt -59.55 -40.49 87.44 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -73.41 -38.57 65.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.101 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -55.62 -37.28 67.97 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -157.43 108.3 1.85 Allowed Pre-proline 0 CA--C 1.539 0.54 0 O-C-N 123.13 0.269 . . . . 0.0 110.38 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.64 -39.01 84.64 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.513 2.142 . . . . 0.0 112.843 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 85.0 p -63.53 -36.73 84.76 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.159 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -69.37 -23.34 63.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 85.0 p -47.6 -42.88 24.98 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 117.798 0.272 . . . . 0.0 111.69 -177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.35 -51.36 69.13 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.018 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.0 -39.51 94.27 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.032 0.444 . . . . 0.0 110.041 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 45.6 mt -63.33 -34.7 78.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.651 179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.35 -39.6 93.66 Favored 'General case' 0 C--O 1.228 -0.037 0 O-C-N 123.737 0.648 . . . . 0.0 109.843 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -49.81 70.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.447 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -68.44 -39.26 81.56 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.211 0.319 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.91 -46.55 87.26 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.93 -36.78 85.08 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.273 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -67.72 -34.93 77.85 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.6 tp -63.82 -39.38 94.1 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.467 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.47 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.4 -39.48 83.58 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 177.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.83 -33.07 65.94 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.304 178.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.53 -35.0 63.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.869 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -94.0 -6.31 45.62 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.702 -179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.452 -0.369 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.858 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.698 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -126.42 146.65 49.99 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.858 178.449 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.418 ' CG2' ' SD ' ' C' ' 35' ' ' MET . 18.1 t -140.2 135.69 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 123.305 0.378 . . . . 0.0 110.744 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.818 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -100.37 127.26 46.73 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.123 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.442 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 44.0 p90 -138.71 156.65 47.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.491 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.41 132.82 54.55 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.201 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -109.0 135.09 50.74 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.352 0.407 . . . . 0.0 110.625 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.32 115.1 15.74 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.555 HG11 HG13 ' C' ' 31' ' ' ILE . 15.5 m -123.47 -10.93 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.17 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 -122.12 28.52 Favored Glycine 0 C--N 1.34 0.755 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.4 m 48.2 28.22 1.5 Allowed 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 67.05 2.08 2.59 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.826 -178.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -95.76 -7.3 37.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.215 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 66.45 -99.45 0.46 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 108.979 -1.649 . . . . 0.0 108.979 -178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.03 164.81 23.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' E' ' 20' ' ' PRO . 4.6 mt -112.09 130.09 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.05 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.7 mm -81.49 118.71 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.25 149.83 20.94 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.61 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.33 151.53 48.64 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 121.365 0.602 . . . . 0.0 110.555 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.418 ' SD ' ' CG2' ' C' ' 18' ' ' VAL . 2.9 ptm -98.33 145.26 26.87 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.453 -1.248 . . . . 0.0 108.814 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.48 117.66 51.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 O-C-N 123.468 0.48 . . . . 0.0 111.354 -178.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.15 136.14 0.03 OUTLIER Glycine 0 C--N 1.341 0.83 0 O-C-N 123.514 0.509 . . . . 0.0 113.568 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.12 176.57 41.42 Favored Glycine 0 N--CA 1.464 0.526 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 12.4 p -130.68 145.39 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.453 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.324 -179.967 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.788 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -93.44 124.39 37.39 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.3 mt -107.38 128.14 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.656 0.741 . . . . 0.0 111.1 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.658 HG21 HD21 ' E' ' 45' ' ' LEU . 47.1 t -108.07 146.72 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 113.984 -1.462 . . . . 0.0 111.986 -178.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -127.06 125.11 40.78 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.615 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 29.8 mt -123.19 46.18 1.29 Allowed Pre-proline 0 CA--C 1.548 0.869 0 O-C-N 123.326 0.391 . . . . 0.0 111.704 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.588 ' HB3' HG23 ' C' ' 31' ' ' ILE . 30.6 Cg_endo -65.29 -21.37 61.68 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 121.504 1.469 . . . . 0.0 110.854 178.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.44 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 81.6 m-20 -71.02 -19.88 62.46 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.878 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.414 ' HA ' ' NE2' ' E' ' 55' ' ' GLN . 11.0 mp -83.83 140.03 32.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.221 0.534 . . . . 0.0 111.976 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.422 ' H ' HE22 ' E' ' 55' ' ' GLN . 29.8 m-80 -68.39 156.33 90.59 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-N 114.892 -1.049 . . . . 0.0 108.852 178.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.63 -33.69 80.38 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 122.043 1.829 . . . . 0.0 111.056 179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.3 -47.34 76.93 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.003 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.79 -43.51 96.1 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.493 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.47 -38.32 89.36 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.33 -44.68 86.99 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.847 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.41 -45.97 92.09 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.323 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.541 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 43.6 t80 -65.43 -49.53 68.82 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.945 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.818 HD11 ' CE2' ' C' ' 19' ' ' PHE . 39.0 mt -58.75 -36.29 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -70.48 -50.13 41.21 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.394 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.2 t -65.37 -41.7 93.52 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.176 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.698 HD21 HD22 ' C' ' 17' ' ' LEU . 57.6 tp -56.76 -42.88 80.11 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.652 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -75.46 -41.49 55.52 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.904 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.3 -39.89 73.45 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.663 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -131.05 90.95 37.67 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.266 0.354 . . . . 0.0 110.883 -179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.3 -29.66 25.71 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.543 2.162 . . . . 0.0 112.166 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -60.98 -38.33 85.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.547 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -91.81 12.85 20.09 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.383 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 88.7 p -54.83 -36.67 65.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.24 -48.0 66.3 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.707 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 24.5 m120 -65.21 -48.66 72.6 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 39.9 mt -58.51 -42.14 87.02 Favored 'General case' 0 C--O 1.239 0.511 0 O-C-N 123.626 0.579 . . . . 0.0 110.388 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.68 HD11 ' HE2' ' E' ' 49' ' ' LYS . 16.7 tp -63.38 -36.58 84.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.013 178.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -56.69 -37.4 70.83 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -70.45 -39.62 74.22 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.414 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.427 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -68.32 -28.63 67.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.68 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.28 -42.73 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.471 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -60.28 -36.78 78.62 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.7 OUTLIER -65.29 -40.42 93.81 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.855 177.454 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.5 t30 -55.6 -39.78 71.22 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -80.5 -31.86 37.11 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.282 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.37 -29.75 70.5 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.958 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.422 HE22 ' H ' ' E' ' 23' ' ' ASN . 15.4 mt-30 -118.95 8.48 11.67 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.081 0.467 . . . . 0.0 110.838 -179.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.692 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.961 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.685 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.72 144.41 57.26 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 26.7 mt -117.65 143.16 28.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.893 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 19.8 t -123.73 117.75 52.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.876 -178.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.442 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.6 m-85 -95.57 135.15 37.6 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.533 0.521 . . . . 0.0 110.328 179.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.419 HD22 HD13 ' F' ' 22' ' ' LEU . 16.9 mt -123.23 77.31 52.53 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.877 -178.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -85.65 -59.92 0.02 OUTLIER 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.87 2.38 . . . . 0.0 112.076 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.89 -24.84 66.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.61 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.419 HD13 HD22 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -55.88 148.8 16.2 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.233 -179.241 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -86.48 150.14 50.68 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -58.57 -34.27 98.71 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 121.641 1.561 . . . . 0.0 111.327 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -60.29 -43.29 96.41 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -65.81 -36.98 85.01 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.59 -1.186 . . . . 0.0 109.858 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 42.0 mt -63.65 -38.58 91.65 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -63.02 -48.98 76.44 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.54 -37.04 85.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.711 178.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 30.9 t80 -64.67 -53.96 39.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.822 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.0 mt -60.18 -36.19 66.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.559 -0.292 . . . . 0.0 111.227 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -60.68 -42.1 96.41 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 123.291 0.37 . . . . 0.0 110.311 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . 0.48 ' OG ' HD13 ' F' ' 44' ' ' LEU . 53.7 p -69.05 -37.1 78.36 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.557 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 76.0 mt -60.3 -44.18 95.64 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -72.43 -50.08 28.94 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.801 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.58 -39.41 84.03 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.328 0.392 . . . . 0.0 111.831 -178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -132.75 83.11 54.11 Favored Pre-proline 0 CA--C 1.54 0.567 0 O-C-N 123.379 0.424 . . . . 0.0 110.738 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -54.17 -42.23 69.03 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.522 2.148 . . . . 0.0 112.26 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 28.7 m -59.65 -38.55 81.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -74.88 -14.22 60.64 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.445 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -47.43 -43.17 23.6 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 117.987 0.358 . . . . 0.0 111.709 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.11 -48.95 79.3 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 123.526 0.516 . . . . 0.0 110.914 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -66.03 -41.04 91.45 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.996 0.426 . . . . 0.0 110.149 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.48 HD13 ' OG ' ' F' ' 33' ' ' SER . 36.0 mt -62.25 -34.2 76.08 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.514 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.46 -40.02 95.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.802 179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.55 72.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.469 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.4 -41.43 80.5 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.022 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.93 -45.19 95.69 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.343 0.592 . . . . 0.0 109.483 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 16.6 ttmt -64.93 -36.08 83.21 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.23 177.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.91 -35.38 76.77 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' F' ' 51' ' ' LEU . 11.9 tp -64.13 -38.94 92.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.486 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -41.43 88.1 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 177.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -71.08 -34.58 71.31 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.239 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.97 -34.7 69.16 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.01 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.0 -5.25 48.02 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.914 0.388 . . . . 0.0 110.679 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.36 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.863 -179.223 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.459 ' NZ ' HG23 ' C' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.503 HD13 ' O ' ' C' ' 35' ' ' MET . 2.4 mm? -102.43 141.81 34.65 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.087 0.242 . . . . 0.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.459 HG23 ' NZ ' ' C' ' 16' ' ' LYS . 16.1 t -137.41 135.8 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.797 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.812 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.5 OUTLIER -106.34 130.27 54.2 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.222 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -141.41 157.64 44.91 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.51 0.506 . . . . 0.0 111.263 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.14 131.3 53.89 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' C' ' 30' ' ' ALA . 5.4 pt-20 -105.84 126.14 51.83 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.67 116.23 6.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.307 0.575 . . . . 0.0 111.197 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.598 HG21 ' CG1' ' C' ' 31' ' ' ILE . 18.6 m -133.54 117.24 26.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.785 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -82.97 15.74 31.05 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.318 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 11.4 t -79.3 43.49 0.54 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.681 0.277 . . . . 0.0 111.059 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.79 36.56 16.12 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.378 0.609 . . . . 0.0 110.31 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -138.5 -21.72 1.02 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.988 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.89 -68.41 3.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . 0.473 ' HA ' HG22 ' C' ' 24' ' ' VAL . . . -147.86 152.3 37.38 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 177.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.598 ' CG1' HG21 ' C' ' 24' ' ' VAL . 4.0 mt -107.44 131.54 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.464 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.9 mm -82.55 119.7 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.21 150.72 22.33 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 178.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.598 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.2 OUTLIER -125.16 158.92 32.75 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.451 0.644 . . . . 0.0 111.219 -179.581 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.503 ' O ' HD13 ' C' ' 17' ' ' LEU . 1.0 OUTLIER -104.56 145.45 30.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.793 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.9 t -132.13 124.44 52.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 123.485 0.491 . . . . 0.0 111.579 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.79 108.91 0.74 Allowed Glycine 0 N--CA 1.474 1.189 0 CA-C-N 116.389 -0.369 . . . . 0.0 113.388 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.76 -176.99 5.28 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 110.144 -1.182 . . . . 0.0 110.144 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -130.1 148.05 33.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.35 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . 0.408 ' H ' ' HE1' ' C' ' 35' ' ' MET . 14.4 p . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.894 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.084 0.269 . . . . 0.0 112.447 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -83.9 132.08 34.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.21 128.23 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 121.484 0.659 . . . . 0.0 111.094 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -107.84 145.36 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 114.157 -1.383 . . . . 0.0 112.144 -178.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -128.57 125.94 39.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.634 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.485 ' HB3' HD22 ' E' ' 22' ' ' LEU . 11.1 mt -123.9 53.4 6.34 Favored Pre-proline 0 CA--C 1.546 0.793 0 O-C-N 123.292 0.37 . . . . 0.0 110.745 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.458 ' HB3' HG23 ' C' ' 31' ' ' ILE . 19.7 Cg_endo -63.63 -14.94 45.71 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.087 1.858 . . . . 0.0 111.452 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 77.1 m-20 -84.32 -5.5 59.27 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.559 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.485 HD22 ' HB3' ' E' ' 19' ' ' LEU . 8.5 mp -95.01 133.02 39.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.934 0.397 . . . . 0.0 110.921 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.418 HD22 ' N ' ' E' ' 23' ' ' ASN . 1.6 m-80 -70.18 160.28 81.37 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.597 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -52.71 -32.05 53.37 Favored 'Trans proline' 0 N--CA 1.503 2.035 0 C-N-CA 122.044 1.829 . . . . 0.0 111.42 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -66.59 -47.85 71.41 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.535 178.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.4 -44.28 91.77 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.942 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.51 -43.4 94.21 Favored 'General case' 0 C--N 1.342 0.252 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 44.5 t -63.74 -40.27 96.32 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.392 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.74 91.12 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.139 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.441 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 33.5 t80 -66.51 -51.22 58.95 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.927 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.812 HD11 ' CE2' ' C' ' 19' ' ' PHE . 66.4 mt -58.15 -35.6 53.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.612 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -66.11 -50.53 63.72 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.933 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 25.9 t -66.23 -39.84 89.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.992 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.47 HD11 ' HG ' ' C' ' 17' ' ' LEU . 20.7 tp -59.8 -38.06 80.89 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.337 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -82.08 -52.71 6.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.825 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.29 -38.32 83.25 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -123.67 80.62 55.17 Favored Pre-proline 0 N--CA 1.47 0.536 0 O-C-N 123.267 0.354 . . . . 0.0 110.859 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.71 -23.11 19.76 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.44 2.093 . . . . 0.0 112.217 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 22.5 m -59.45 -38.86 81.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -97.63 12.7 32.68 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.082 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.408 ' HB2' HD23 ' C' ' 17' ' ' LEU . 93.9 p -50.57 -37.56 40.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 -178.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.84 -48.03 64.54 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.426 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -63.98 -44.63 92.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.433 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.95 -37.5 76.87 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.475 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.681 HD22 ' HE3' ' E' ' 49' ' ' LYS . 0.3 OUTLIER -64.01 -37.16 86.41 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.087 179.622 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.78 -35.78 69.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -69.74 -43.28 72.61 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.684 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -71.2 -32.97 69.5 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.939 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.681 ' HE3' HD22 ' E' ' 45' ' ' LEU . 88.3 mttt -69.22 -41.52 76.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -62.1 -32.15 72.68 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 176.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -70.06 -39.54 75.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.714 177.105 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 56.8 t30 -56.63 -39.51 73.79 Favored 'General case' 0 C--N 1.347 0.491 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.407 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.1 t70 -79.72 -31.69 41.14 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.395 177.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -66.32 -29.26 69.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.01 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -118.45 7.81 11.97 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.478 0.486 . . . . 0.0 110.752 -178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.709 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.947 -179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.619 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 70.0 tt0 -64.46 145.85 55.45 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 35.1 mt -117.12 142.03 32.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.033 178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 t -123.44 123.15 66.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.571 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -99.87 137.55 38.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.627 0.579 . . . . 0.0 110.812 179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.863 HD12 HD13 ' F' ' 22' ' ' LEU . 2.8 mm? -116.86 72.91 6.01 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.356 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -80.43 -56.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.777 2.318 . . . . 0.0 113.08 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -82.18 3.09 28.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.802 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.863 HD13 HD12 ' F' ' 19' ' ' LEU . 0.4 OUTLIER -76.55 144.98 39.34 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.32 -179.8 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -77.19 148.66 78.36 Favored Pre-proline 0 N--CA 1.464 0.247 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -62.72 -33.94 75.1 Favored 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 121.444 1.429 . . . . 0.0 110.93 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -62.27 -39.23 92.23 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.492 ' HG2' HD23 ' F' ' 51' ' ' LEU . 53.3 tp60 -65.85 -37.67 86.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.602 178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 38.1 mt -62.93 -40.12 96.66 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.316 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 88.1 m -61.92 -45.21 94.69 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -39.55 93.76 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.727 ' CE2' HD11 ' F' ' 34' ' ' LEU . 28.6 t80 -62.38 -53.73 50.68 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.508 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.663 ' HA ' HD12 ' F' ' 34' ' ' LEU . 98.7 mt -61.33 -37.78 78.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.814 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.72 -43.77 97.45 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.033 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 77.9 p -68.3 -37.33 80.52 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.727 HD11 ' CE2' ' F' ' 30' ' ' PHE . 34.7 mt -60.8 -46.33 90.95 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -71.51 -47.22 56.75 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.929 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -59.13 -41.99 89.55 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.279 0.362 . . . . 0.0 111.507 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -132.76 85.2 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 O-C-N 123.246 0.341 . . . . 0.0 110.821 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -57.78 -34.54 98.37 Favored 'Trans proline' 0 N--CA 1.503 2.039 0 C-N-CA 122.031 1.821 . . . . 0.0 111.938 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -61.93 -36.14 80.5 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.813 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -87.15 -5.27 59.06 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.204 -178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.404 ' HA ' HD12 ' F' ' 44' ' ' LEU . 60.4 p -52.52 -41.21 63.25 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.15 -48.88 78.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.19 178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -64.32 -39.25 93.53 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' F' ' 41' ' ' SER . 33.9 mt -63.17 -37.9 89.05 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.317 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -39.34 88.11 Favored 'General case' 0 C--O 1.228 -0.069 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.18 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.24 -54.26 40.1 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.065 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -68.34 -37.7 80.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.571 -0.451 . . . . 0.0 111.161 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.14 -45.21 94.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 ttmm -64.68 -38.74 92.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 177.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -65.44 -35.08 79.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.492 HD23 ' HG2' ' F' ' 26' ' ' GLN . 10.5 tp -63.3 -39.22 93.96 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.704 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -59.59 -38.68 81.89 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -74.72 -31.57 61.88 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.534 178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.77 -34.87 60.26 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.651 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.4 -7.66 44.0 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.589 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.376 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.941 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.629 HD13 ' O ' ' C' ' 35' ' ' MET . 4.3 mm? -108.45 130.77 55.24 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.305 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 31.3 t -128.76 130.48 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.841 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -98.85 127.17 44.7 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.447 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 38.4 p90 -136.82 158.8 43.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.99 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -119.98 135.06 55.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.846 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -107.53 126.13 52.14 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -76.79 113.76 14.82 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.524 HG11 ' CD1' ' C' ' 31' ' ' ILE . 13.2 m -117.17 -10.44 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.472 -177.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 -124.57 36.96 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 -178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.7 m 49.06 27.87 1.87 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 19.6 m120 67.21 3.05 3.04 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.141 -178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -96.74 -5.03 39.61 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.278 178.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.82 -106.74 1.79 Allowed Glycine 0 C--N 1.337 0.597 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.06 164.85 19.31 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.695 0.283 . . . . 0.0 110.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.524 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -113.59 139.0 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.914 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -87.95 117.27 31.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.81 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 147.95 19.37 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 108.43 -1.868 . . . . 0.0 108.43 178.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.524 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.59 155.06 44.44 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.683 0.754 . . . . 0.0 111.537 -179.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.629 ' O ' HD13 ' C' ' 17' ' ' LEU . 3.4 tpp -96.71 142.49 28.67 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.881 -1.508 . . . . 0.0 109.461 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.468 ' N ' ' HG3' ' C' ' 35' ' ' MET . 3.6 t -122.75 112.64 34.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 O-C-N 123.824 0.703 . . . . 0.0 110.479 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.9 137.22 0.06 OUTLIER Glycine 0 C--N 1.338 0.65 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.014 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.91 -171.35 54.45 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.38 -0.41 . . . . 0.0 112.345 178.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 36.4 t -132.91 154.86 40.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 115.26 -0.47 . . . . 0.0 110.816 -179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.162 179.399 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 CA-C-O 121.001 0.223 . . . . 0.0 112.857 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -89.24 129.74 35.76 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . 0.489 HG12 ' SD ' ' C' ' 35' ' ' MET . 10.8 mt -111.98 127.06 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.447 0.641 . . . . 0.0 111.241 -178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.772 HG21 HD21 ' E' ' 45' ' ' LEU . 77.5 t -104.49 146.07 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 CA-C-N 114.225 -1.352 . . . . 0.0 112.429 -177.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -125.43 122.66 37.34 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.267 -0.878 . . . . 0.0 108.76 176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.489 HD13 HD12 ' E' ' 22' ' ' LEU . 78.2 mt -118.36 60.07 3.91 Favored Pre-proline 0 CA--C 1.546 0.806 0 O-C-N 123.568 0.542 . . . . 0.0 110.913 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.467 ' HB3' HG23 ' C' ' 31' ' ' ILE . 43.4 Cg_endo -69.19 -24.58 32.13 Favored 'Trans proline' 0 N--CA 1.5 1.902 0 C-N-CA 122.662 2.241 . . . . 0.0 111.43 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -81.53 -3.19 52.49 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.085 -0.962 . . . . 0.0 112.435 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.593 HD22 ' HG2' ' E' ' 26' ' ' GLN . 55.0 mt -97.48 134.08 41.19 Favored 'General case' 0 C--N 1.345 0.385 0 CA-C-O 121.522 0.677 . . . . 0.0 111.417 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.427 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.3 p30 -73.0 160.23 83.4 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.303 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -52.57 -30.29 44.4 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.049 1.833 . . . . 0.0 111.948 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.68 -48.88 67.95 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.218 179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.593 ' HG2' HD22 ' E' ' 22' ' ' LEU . 10.6 tp-100 -65.37 -42.81 92.33 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.736 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . 0.431 HD21 ' HB2' ' E' ' 22' ' ' LEU . 96.2 mt -63.09 -43.42 98.56 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -64.94 -42.98 94.18 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.92 92.04 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.614 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.402 ' CE2' HD22 ' E' ' 34' ' ' LEU . 29.3 t80 -66.04 -50.64 63.48 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.841 HD11 ' CE2' ' C' ' 19' ' ' PHE . 60.9 mt -58.1 -34.34 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.423 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.24 -50.64 65.03 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 109.918 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 30.4 t -67.19 -41.08 86.46 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.113 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.475 HD11 ' HG ' ' C' ' 17' ' ' LEU . 19.3 tp -57.19 -42.82 81.94 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.604 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -72.98 -47.5 44.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.357 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -60.14 -39.48 86.45 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -127.98 83.64 65.54 Favored Pre-proline 0 CA--C 1.54 0.574 0 O-C-N 123.069 0.231 . . . . 0.0 111.316 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.71 -29.22 19.63 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 122.485 2.124 . . . . 0.0 112.005 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 39.6 t -61.87 -35.32 77.94 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.637 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -96.17 8.35 44.06 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.648 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 95.4 p -52.2 -34.75 46.85 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.51 78.11 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.486 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.497 ' O ' ' HB3' ' E' ' 46' ' ' ALA . 10.2 t-20 -69.57 -44.48 70.75 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.693 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.78 -42.46 89.03 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.157 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.772 HD21 HG21 ' E' ' 17' ' ' VAL . 24.5 tp -63.99 -35.74 81.68 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.811 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' O ' ' E' ' 43' ' ' ASN . . . -55.43 -37.06 67.19 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -70.45 -43.04 70.69 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.55 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.26 -28.42 67.19 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 123.992 0.808 . . . . 0.0 109.982 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -70.51 -46.92 62.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 178.327 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -61.44 -31.08 71.02 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.479 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.1 OUTLIER -71.45 -40.23 70.49 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.799 -1.091 . . . . 0.0 108.68 177.583 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.451 ' HB2' ' CD2' ' E' ' 19' ' ' LEU . 15.9 t-20 -56.29 -39.34 72.53 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.186 -0.916 . . . . 0.0 108.605 179.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.487 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 58.3 m-20 -79.5 -29.09 41.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.376 178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.57 -23.58 66.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.537 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.427 HE22 ' ND2' ' E' ' 23' ' ' ASN . 22.6 mt-30 -122.6 6.95 9.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.073 0.464 . . . . 0.0 110.575 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.537 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.689 0 N-CA-C 111.664 -0.574 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -92.45 141.39 28.58 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.831 0.348 . . . . 0.0 110.227 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 88.1 mt -115.99 146.59 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.409 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 6.6 t -130.41 116.29 35.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.34 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.447 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.8 m-85 -93.31 136.57 33.45 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.94 0.4 . . . . 0.0 110.627 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 5.4 mt -123.46 74.83 53.03 Favored Pre-proline 0 CA--C 1.544 0.736 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.394 -177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -81.96 -48.31 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.974 2.449 . . . . 0.0 113.298 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.09 7.11 19.76 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.414 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.46 151.57 27.78 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.143 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.432 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.7 p30 -90.4 148.97 40.15 Favored Pre-proline 0 N--CA 1.468 0.438 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.16 -33.54 98.29 Favored 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.914 1.743 . . . . 0.0 111.686 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.37 -39.43 83.26 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -68.77 -39.37 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.946 178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' F' ' 27' ' ' LEU . 69.9 mt -60.43 -41.46 94.06 Favored 'General case' 0 C--N 1.349 0.554 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.243 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 12.9 t -62.04 -43.83 98.0 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.61 93.72 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.428 178.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.6 ' CE2' HD11 ' F' ' 34' ' ' LEU . 31.4 t80 -61.2 -53.99 49.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.187 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.409 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.2 mt -58.71 -39.93 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 123.161 0.288 . . . . 0.0 110.797 -179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.16 -39.25 89.4 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.0 m -67.53 -41.19 84.77 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.416 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.6 HD11 ' CE2' ' F' ' 30' ' ' PHE . 82.1 mt -59.5 -41.4 89.82 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.88 -50.55 14.73 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.502 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -60.48 -39.98 89.62 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.954 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -130.1 80.01 71.77 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.235 0.334 . . . . 0.0 110.781 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.42 -35.0 98.88 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 122.508 2.139 . . . . 0.0 111.804 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 18.7 t -61.86 -34.87 76.76 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.967 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -92.32 2.55 56.57 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 119.104 -0.474 . . . . 0.0 112.094 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 82.8 p -51.31 -41.81 60.77 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.552 0.614 . . . . 0.0 110.472 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.38 -47.68 78.31 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.667 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -62.06 -43.62 98.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.215 0.531 . . . . 0.0 110.05 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.63 -35.33 77.59 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 115.089 -0.96 . . . . 0.0 109.448 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.65 -37.56 84.48 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.946 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -59.27 5.03 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.358 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -62.47 -40.12 95.63 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.117 0.26 . . . . 0.0 111.273 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.22 90.19 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 5.8 ttmm -69.33 -39.04 78.43 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.987 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -61.28 -36.32 79.74 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' F' ' 51' ' ' LEU . 25.0 mt -61.86 -39.68 92.74 Favored 'General case' 0 CA--C 1.512 -0.489 0 O-C-N 123.12 0.263 . . . . 0.0 110.446 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.545 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.41 -36.24 71.07 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -79.88 -34.45 39.13 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.465 178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.09 -38.3 69.39 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.797 -179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -89.14 -9.39 51.17 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.73 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.448 -0.528 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.839 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.618 ' HG ' HD11 ' E' ' 34' ' ' LEU . 3.9 mm? -118.19 142.49 47.39 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 114.264 -1.335 . . . . 0.0 108.444 177.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . 0.424 HG21 ' SD ' ' C' ' 35' ' ' MET . 19.7 t -134.73 128.12 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.835 ' CE2' HD11 ' E' ' 31' ' ' ILE . 1.2 m-85 -97.77 132.04 43.74 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.289 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.418 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 49.6 p90 -142.44 155.95 45.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.969 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -117.46 131.2 56.78 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -107.47 131.24 54.51 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 123.365 0.415 . . . . 0.0 110.189 -179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -76.07 118.99 19.4 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.5 m -122.85 -10.83 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.432 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.79 -125.53 39.96 Favored Glycine 0 C--N 1.34 0.751 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.1 m 50.51 26.23 2.3 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 177.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 67.49 4.22 3.7 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.729 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -97.05 -5.6 37.21 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.386 178.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 67.77 -105.15 1.31 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.162 -1.575 . . . . 0.0 109.162 -178.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -125.94 165.32 18.97 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.1 mt -117.09 139.32 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.13 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.442 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.0 OUTLIER -85.19 122.76 38.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 O-C-N 123.752 0.658 . . . . 0.0 109.902 178.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.06 153.27 21.07 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 108.765 -1.734 . . . . 0.0 108.765 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.732 HD13 ' H ' ' C' ' 34' ' ' LEU . 0.0 OUTLIER -136.43 137.52 40.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.314 0.578 . . . . 0.0 111.217 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.585 ' O ' HD13 ' C' ' 17' ' ' LEU . 2.0 ptm -89.96 146.26 24.51 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.286 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . 0.4 HG22 HD11 ' C' ' 17' ' ' LEU . 8.5 t -124.91 126.66 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 O-C-N 123.641 0.588 . . . . 0.0 111.552 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.64 116.88 0.09 OUTLIER Glycine 0 N--CA 1.466 0.652 0 N-CA-C 114.88 0.712 . . . . 0.0 114.88 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.24 -179.55 35.77 Favored Glycine 0 C--N 1.336 0.583 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -127.64 145.95 34.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 118.088 -0.958 . . . . 0.0 110.14 -179.952 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.999 0 N-CA-C 112.334 -0.306 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -85.67 127.35 34.47 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 mt -105.82 127.45 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.588 0.708 . . . . 0.0 110.898 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.557 HG21 HD21 ' E' ' 45' ' ' LEU . 39.2 t -106.81 146.92 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.786 -178.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -127.89 126.12 40.94 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.173 177.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 51.7 mt -121.47 63.07 13.35 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.75 -29.75 23.42 Favored 'Trans proline' 0 N--CA 1.505 2.175 0 C-N-CA 123.347 2.698 . . . . 0.0 113.223 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -89.58 4.1 50.43 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 6.6 mp -91.01 129.45 37.02 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.261 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.45 ' ND2' HE22 ' E' ' 55' ' ' GLN . 2.6 p30 -67.91 155.34 91.99 Favored Pre-proline 0 C--O 1.235 0.301 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.727 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -51.55 -33.31 47.44 Favored 'Trans proline' 0 N--CA 1.5 1.855 0 C-N-CA 122.076 1.851 . . . . 0.0 112.098 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -65.15 -45.59 84.36 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.972 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -66.07 -43.86 86.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.94 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 98.1 mt -62.41 -42.63 99.59 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -64.0 -42.94 97.02 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.908 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.51 -45.73 92.99 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.455 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.587 ' CZ ' HD22 ' E' ' 34' ' ' LEU . 26.1 t80 -64.41 -52.26 59.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.748 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.835 HD11 ' CE2' ' C' ' 19' ' ' PHE . 73.0 mt -58.55 -35.34 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.647 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -64.64 -50.65 66.24 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.969 0.414 . . . . 0.0 110.173 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 27.3 t -68.87 -42.77 76.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.22 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.618 HD11 ' HG ' ' C' ' 17' ' ' LEU . 32.4 tp -56.71 -38.53 72.43 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.737 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -78.89 -53.19 7.33 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.569 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -60.24 -37.36 80.13 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -120.87 79.38 32.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 123.142 0.276 . . . . 0.0 110.898 -178.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.59 -24.25 26.1 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.432 2.088 . . . . 0.0 111.965 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 23.0 m -61.62 -35.81 78.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -93.71 17.71 11.42 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 1.7 m -47.1 -51.26 18.32 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -178.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.62 79.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' E' ' 47' ' ' GLU . 32.9 m120 -61.91 -52.08 65.54 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.34 0.4 . . . . 0.0 111.471 -179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 80.8 mt -58.16 -47.47 83.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.445 0.466 . . . . 0.0 110.768 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.557 HD21 HG21 ' E' ' 17' ' ' VAL . 22.3 tp -63.07 -35.73 81.22 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.208 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.43 -38.01 71.0 Favored 'General case' 0 N--CA 1.46 0.072 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' E' ' 43' ' ' ASN . 5.2 mt-10 -70.44 -38.71 74.57 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.238 178.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.485 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -67.73 -31.49 71.45 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 -41.49 78.1 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -62.1 -36.11 80.71 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -64.64 -39.6 93.97 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.051 178.091 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -56.46 -40.17 74.41 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.017 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.488 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.47 -31.24 37.39 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.296 177.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.24 -26.41 68.1 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.965 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.45 HE22 ' ND2' ' E' ' 23' ' ' ASN . 19.1 mt-30 -120.58 2.14 10.66 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.89 0.376 . . . . 0.0 110.681 -179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.45 -0.441 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.999 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.466 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -64.53 143.98 57.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.0 mt -118.16 145.64 23.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.559 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 45.6 t -131.62 120.72 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.572 -178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.418 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.8 m-85 -99.98 137.33 38.58 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.413 0.446 . . . . 0.0 111.211 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.886 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -118.74 74.38 12.36 Favored Pre-proline 0 CA--C 1.547 0.848 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.222 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.81 -60.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 122.734 2.29 . . . . 0.0 111.689 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -60.9 -26.42 67.44 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.886 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -56.44 147.75 20.91 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.72 -179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' F' ' 23' ' ' ASN . 1.8 p30 -90.3 152.62 45.89 Favored Pre-proline 0 N--CA 1.469 0.491 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -34.28 98.74 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 121.918 1.745 . . . . 0.0 111.971 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -60.53 -39.84 89.3 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.533 ' HG2' HD23 ' F' ' 51' ' ' LEU . 59.6 tp60 -69.52 -40.12 77.13 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.937 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 29.8 mt -59.24 -40.03 84.62 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.5 t -61.79 -50.05 73.91 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.965 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.95 94.37 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.722 178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.599 ' CE2' HD11 ' F' ' 34' ' ' LEU . 35.8 t80 -61.59 -53.52 55.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.862 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.401 HD11 HD11 ' E' ' 31' ' ' ILE . 97.0 mt -58.77 -38.83 74.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 123.329 0.393 . . . . 0.0 111.029 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.04 -40.78 96.9 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 16.9 m -62.98 -40.59 98.21 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.682 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' F' ' 30' ' ' PHE . 84.0 mt -61.72 -38.21 87.05 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.956 -0.386 . . . . 0.0 109.956 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -77.53 -34.95 53.82 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.471 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -55.24 -39.05 69.28 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.512 0.196 . . . . 0.0 111.355 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -159.26 113.08 1.55 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.658 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -60.85 -27.65 85.14 Favored 'Trans proline' 0 N--CA 1.493 1.484 0 C-N-CA 122.026 1.817 . . . . 0.0 112.032 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 1.8 m -63.76 -39.55 94.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 110.108 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -73.08 -21.19 60.81 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.941 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -47.25 -44.17 22.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -177.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.36 -50.62 72.88 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.877 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -63.85 -40.82 97.48 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.859 0.361 . . . . 0.0 110.219 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 35.5 mt -62.51 -35.03 78.1 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.758 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -62.07 -39.79 93.6 Favored 'General case' 0 CA--C 1.528 0.099 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.901 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.38 -48.16 76.5 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.715 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -68.66 -40.16 80.32 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.703 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.2 -48.01 80.16 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' F' ' 52' ' ' ASN . 22.1 ttmt -64.6 -35.48 81.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.112 177.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.39 -34.53 76.2 Favored 'General case' 0 CA--C 1.522 -0.113 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.533 HD23 ' HG2' ' F' ' 26' ' ' GLN . 7.3 tp -64.73 -37.94 89.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.071 -0.968 . . . . 0.0 108.691 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 50.2 t-20 -55.94 -39.59 71.95 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.476 177.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -74.76 -38.15 62.26 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.488 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.5 -31.94 69.25 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.093 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -95.77 -10.0 30.23 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.482 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.006 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.493 HD22 HD13 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -105.0 146.42 29.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.92 178.658 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -134.53 138.45 49.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.435 -178.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.3 OUTLIER -106.45 129.55 54.4 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 179.077 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.439 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 32.8 p90 -140.1 156.48 46.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.536 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.13 132.92 56.31 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -105.2 130.88 53.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 123.459 0.474 . . . . 0.0 110.129 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.43 115.56 17.3 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.492 HG11 ' CD1' ' C' ' 31' ' ' ILE . 9.9 m -122.42 -14.66 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.454 -177.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.09 -124.59 37.16 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.824 -1.71 . . . . 0.0 108.824 -178.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 4.4 m 50.43 27.14 2.64 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 67.57 4.26 3.76 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.829 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -98.02 -3.61 37.79 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.169 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.66 -110.47 3.51 Favored Glycine 0 C--N 1.336 0.554 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.61 163.44 18.94 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.492 ' CD1' HG11 ' C' ' 24' ' ' VAL . 52.8 mt -112.54 136.07 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.029 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.412 HD13 ' HA ' ' C' ' 32' ' ' ILE . 1.9 mm -86.56 117.08 30.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.905 178.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.59 148.0 19.34 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.459 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.58 157.32 39.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.206 0.527 . . . . 0.0 110.961 -179.478 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.492 ' SD ' ' HA2' ' C' ' 38' ' ' GLY . 0.0 OUTLIER -108.93 139.2 44.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.787 179.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.5 t -108.51 114.72 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.031 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.63 32.55 84.59 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . 0.647 ' O ' HG12 ' C' ' 40' ' ' VAL . . . -71.66 79.85 0.56 Allowed Glycine 0 N--CA 1.443 -0.9 0 CA-C-N 113.688 -1.256 . . . . 0.0 110.644 -178.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . 0.417 ' O ' HG13 ' C' ' 39' ' ' VAL . 5.9 p -53.6 113.86 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 O-C-N 123.937 0.433 . . . . 0.0 110.128 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . 0.647 HG12 ' O ' ' C' ' 38' ' ' GLY . 13.2 p . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 117.959 -1.02 . . . . 0.0 110.512 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -74.91 127.77 33.99 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -111.33 125.67 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-O 121.079 0.466 . . . . 0.0 110.44 -178.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.531 HG21 HD21 ' E' ' 45' ' ' LEU . 54.1 t -110.34 143.62 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.265 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -124.97 127.45 47.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.641 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.434 HD13 HD22 ' E' ' 22' ' ' LEU . 47.8 mt -123.57 62.44 24.07 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.455 ' HB3' HG23 ' C' ' 31' ' ' ILE . 47.5 Cg_endo -68.84 -26.52 32.03 Favored 'Trans proline' 0 N--CA 1.504 2.089 0 C-N-CA 123.117 2.545 . . . . 0.0 112.873 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.404 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 6.8 p30 -90.69 3.06 55.29 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.434 HD22 HD13 ' E' ' 19' ' ' LEU . 7.7 mp -91.68 128.78 37.64 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.05 179.144 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -66.09 159.6 69.82 Favored Pre-proline 0 N--CA 1.466 0.331 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.93 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -53.66 -33.11 68.0 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 122.147 1.898 . . . . 0.0 111.057 179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -64.92 -46.9 79.73 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.481 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -64.64 -46.45 82.51 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' F' ' 31' ' ' ILE . 96.9 mt -63.74 -41.88 97.96 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.201 0.313 . . . . 0.0 110.256 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 37.6 t -68.07 -40.33 82.77 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.74 -44.77 95.34 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.438 0.637 . . . . 0.0 109.651 179.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.66 ' CE2' HD11 ' E' ' 34' ' ' LEU . 32.8 t80 -64.46 -53.69 44.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.861 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.925 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.8 mt -57.17 -35.64 48.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.234 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -65.3 -38.98 91.9 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.2 m -67.48 -41.9 83.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.538 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.66 HD11 ' CE2' ' E' ' 30' ' ' PHE . 71.8 mt -62.71 -41.88 99.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.615 0.722 . . . . 0.0 109.51 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -49.74 66.29 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.247 -1.342 . . . . 0.0 111.031 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -66.09 -38.79 89.14 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.562 -179.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.47 77.93 45.52 Favored Pre-proline 0 N--CA 1.471 0.612 0 O-C-N 123.274 0.359 . . . . 0.0 110.809 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -65.35 -27.54 55.21 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.299 2.0 . . . . 0.0 111.984 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 60.3 p -62.21 -35.93 80.39 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.43 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -92.55 8.67 37.84 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.314 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.406 ' HB2' HD13 ' C' ' 17' ' ' LEU . 97.8 p -53.67 -36.65 62.36 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -47.59 77.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.492 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -67.92 -46.75 70.68 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.954 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 53.3 mt -57.52 -43.39 84.23 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.54 0.525 . . . . 0.0 110.846 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.531 HD21 HG21 ' E' ' 17' ' ' VAL . 16.1 tp -63.15 -36.84 84.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.312 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.83 -34.79 65.71 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -74.85 -36.22 62.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.147 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.509 ' HB3' HD12 ' E' ' 45' ' ' LEU . . . -67.85 -31.7 71.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.406 ' HE2' HG21 ' E' ' 17' ' ' VAL . 0.0 OUTLIER -67.47 -37.21 82.57 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -65.36 -35.54 81.26 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 175.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.9 OUTLIER -65.24 -37.72 88.12 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 115.151 -0.931 . . . . 0.0 108.841 177.157 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 12.0 t-20 -56.13 -40.77 74.29 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 23.2 t70 -80.85 -31.55 35.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.322 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.481 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.23 -29.01 69.76 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.12 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -118.81 3.36 11.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.413 0 CA-C-N 115.206 -0.906 . . . . 0.0 112.389 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.711 0 N-CA-C 111.261 -0.736 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -68.25 144.19 54.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 93.1 mt -116.61 144.53 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.18 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 18.4 t -129.25 121.28 53.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.434 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.439 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 3.1 m-85 -97.96 138.78 34.77 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.595 0.559 . . . . 0.0 110.674 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.69 HD12 HD13 ' F' ' 22' ' ' LEU . 2.7 mm? -116.61 72.12 5.29 Favored Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.494 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -81.63 -51.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.687 2.258 . . . . 0.0 112.611 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -84.93 2.63 41.97 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.155 -179.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.69 HD13 HD12 ' F' ' 19' ' ' LEU . 0.5 OUTLIER -77.59 152.08 34.12 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -83.29 145.78 49.46 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -57.41 -33.18 95.86 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.58 1.52 . . . . 0.0 110.814 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.6 -43.58 93.67 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . . . . . . . . . 30.7 mm100 -66.33 -34.89 78.99 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.408 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' F' ' 27' ' ' LEU . 38.1 mt -63.05 -47.82 81.34 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.494 179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 29.6 m -59.56 -45.27 92.31 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.623 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.36 -39.96 92.98 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.751 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.476 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 20.8 t80 -61.77 -53.22 58.89 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.54 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' E' ' 27' ' ' LEU . 98.7 mt -58.35 -39.82 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 O-C-N 123.341 0.401 . . . . 0.0 110.611 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -59.66 -41.84 91.51 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 18.2 m -64.55 -41.81 96.09 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.309 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 84.1 mt -57.72 -37.05 72.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 120.764 0.316 . . . . 0.0 110.166 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -78.54 -40.7 34.26 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.853 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -57.6 -38.73 75.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -147.22 93.17 4.75 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.383 0.427 . . . . 0.0 110.342 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.27 -44.12 48.66 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 123.127 2.552 . . . . 0.0 113.766 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 65.5 p -62.27 -30.5 71.17 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.465 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -81.7 -9.51 59.63 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.857 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 94.3 p -48.51 -40.15 25.75 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.239 0.472 . . . . 0.0 110.754 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.19 -49.34 74.62 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.114 178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -61.79 -40.07 93.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.036 0.446 . . . . 0.0 109.881 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 40.7 mt -65.46 -33.58 76.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.276 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 mp -63.51 -37.89 89.03 Favored 'General case' 0 N--CA 1.457 -0.08 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.733 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.02 -50.13 71.93 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.525 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -69.91 -41.0 75.25 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.191 0.307 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.41 -44.09 97.74 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -66.11 -38.94 89.45 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.903 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -61.37 -36.42 80.19 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.799 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' F' ' 51' ' ' LEU . 32.0 mt -62.85 -40.26 96.9 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.0 -34.68 68.38 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -80.19 -37.85 32.41 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.247 177.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.79 76.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.435 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -90.82 -17.16 27.04 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.541 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.347 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.915 -179.271 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.284 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.507 HD22 HD11 ' E' ' 34' ' ' LEU . 1.0 OUTLIER -111.39 145.92 38.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.062 0.458 . . . . 0.0 111.38 179.741 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 7.4 t -141.0 131.89 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.743 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.801 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.6 OUTLIER -94.46 129.13 41.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.497 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 36.7 p90 -139.82 160.74 39.21 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.777 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -122.02 130.19 53.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.516 178.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.423 ' O ' HG13 ' C' ' 24' ' ' VAL . 33.3 tt0 -104.15 126.94 51.67 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.943 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.48 117.48 16.35 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' C' ' 31' ' ' ILE . 12.1 m -122.41 -11.41 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.26 -177.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -125.28 39.04 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.011 -1.636 . . . . 0.0 109.011 -178.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 5.1 m 49.42 28.82 2.55 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 178.245 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 66.31 4.23 3.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.15 -178.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -97.03 -5.86 36.65 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.383 178.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.32 -100.08 0.63 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -178.793 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . 0.459 ' HB3' HD11 ' F' ' 34' ' ' LEU . . . -131.26 166.39 21.29 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.501 ' CD1' HG11 ' C' ' 24' ' ' VAL . 44.4 mt -116.5 134.42 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.293 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.465 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.1 mm -82.5 118.58 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 123.687 0.617 . . . . 0.0 109.36 178.328 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.69 149.29 20.12 Favored Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 108.081 -2.008 . . . . 0.0 108.081 178.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.476 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.38 150.74 48.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.88 0.848 . . . . 0.0 111.364 -179.301 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 7.9 ttm -90.05 147.09 23.86 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 113.579 -1.646 . . . . 0.0 108.292 179.043 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 2.5 t -134.69 116.12 20.67 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 O-C-N 123.425 0.453 . . . . 0.0 110.692 -179.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.41 141.35 1.14 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 116.211 -0.45 . . . . 0.0 112.365 178.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.17 -175.14 5.55 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 10.3 p -136.17 145.11 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.238 -179.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.831 179.849 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.881 0 N-CA-C 112.093 -0.403 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -84.42 135.62 34.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -115.19 126.24 72.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.371 0.605 . . . . 0.0 110.466 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.57 HG21 HD21 ' E' ' 45' ' ' LEU . 82.5 t -107.0 145.01 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.63 -177.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -127.35 125.17 40.28 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.984 177.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.465 ' HB3' HD22 ' E' ' 22' ' ' LEU . 21.4 mt -121.63 55.57 5.69 Favored Pre-proline 0 CA--C 1.547 0.84 0 O-C-N 123.19 0.306 . . . . 0.0 110.63 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.437 ' HB3' HG23 ' C' ' 31' ' ' ILE . 21.1 Cg_endo -63.03 -18.22 64.08 Favored 'Trans proline' 0 N--CA 1.5 1.907 0 C-N-CA 122.276 1.984 . . . . 0.0 111.263 179.088 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.421 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 79.8 m-20 -85.41 -3.59 58.89 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.141 -178.311 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.465 HD22 ' HB3' ' E' ' 19' ' ' LEU . 9.2 mp -98.28 133.4 42.74 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.057 0.456 . . . . 0.0 111.081 -179.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.63 164.72 57.98 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.838 179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -54.72 -33.75 81.47 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.069 1.846 . . . . 0.0 110.925 179.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -65.81 -49.16 69.25 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.406 178.267 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.426 ' NE2' HD11 ' E' ' 51' ' ' LEU . 29.9 mm100 -63.12 -45.06 93.76 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.642 179.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.62 -43.66 93.05 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.182 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 42.0 t -63.59 -40.54 97.2 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.272 179.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.95 90.07 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.135 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -65.42 -50.06 66.87 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.349 179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.801 HD11 ' CE2' ' C' ' 19' ' ' PHE . 55.6 mt -59.03 -37.84 70.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.488 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -66.12 -50.23 64.74 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.942 0.401 . . . . 0.0 110.366 -179.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 29.3 t -69.6 -39.08 77.46 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.507 HD11 HD22 ' C' ' 17' ' ' LEU . 33.7 tp -56.84 -41.08 77.24 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.588 179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -82.42 -27.24 32.09 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.335 -179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -55.18 -38.6 68.56 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.573 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -155.76 94.82 2.47 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.389 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -54.94 -21.44 26.53 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 122.741 2.294 . . . . 0.0 112.734 -179.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 6.3 m -60.36 -36.11 77.25 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 120.776 0.322 . . . . 0.0 110.242 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -93.4 11.18 29.26 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.366 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.421 ' HB2' HD13 ' C' ' 17' ' ' LEU . 81.0 p -54.89 -43.0 72.82 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.72 76.02 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.545 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.48 -50.37 69.93 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.998 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 52.0 mt -57.94 -42.96 85.96 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.604 0.565 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.57 HD21 HG21 ' E' ' 17' ' ' VAL . 9.9 tp -63.52 -35.68 81.26 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.937 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.27 -36.73 71.36 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -71.3 -40.43 70.85 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.48 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.472 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -68.12 -34.78 77.02 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.762 0.664 . . . . 0.0 109.525 -178.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.478 ' HE2' HD11 ' E' ' 45' ' ' LEU . 19.8 mttm -69.11 -41.34 77.55 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.482 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -62.73 -30.17 71.23 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 175.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.3 OUTLIER -70.62 -40.43 73.14 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 114.814 -1.085 . . . . 0.0 108.641 177.459 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -56.22 -39.52 72.62 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.854 179.089 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.421 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 52.3 m-20 -80.34 -30.97 38.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.16 177.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.28 -26.48 66.56 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.779 -179.223 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.13 10.19 10.65 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.796 -179.006 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.421 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.712 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.533 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -69.87 143.39 52.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 91.8 mt -117.24 144.57 24.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.226 179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 114.92 29.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.666 -178.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.497 ' CZ ' ' CD2' ' C' ' 20' ' ' PHE . 3.4 m-85 -95.9 135.17 37.99 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.331 0.395 . . . . 0.0 109.957 178.891 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.73 82.0 48.77 Favored Pre-proline 0 CA--C 1.543 0.695 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.677 -177.368 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -88.22 -43.49 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 123.127 2.551 . . . . 0.0 113.46 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -85.43 6.57 26.12 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' F' ' 51' ' ' LEU . 0.4 OUTLIER -81.75 156.67 24.86 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -96.97 148.48 34.45 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.576 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_exo -56.3 -36.53 97.09 Favored 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 121.916 1.744 . . . . 0.0 112.566 -178.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -58.02 -38.23 75.81 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.407 ' CG ' HD21 ' F' ' 22' ' ' LEU . 57.8 tp60 -71.15 -39.54 71.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.379 178.236 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 65.7 mt -59.3 -44.09 92.56 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.044 0.215 . . . . 0.0 111.152 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -62.93 -41.57 99.52 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.936 179.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.74 -38.4 86.57 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.242 0.544 . . . . 0.0 109.914 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -65.95 -54.14 30.15 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.687 -179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 98.4 mt -62.14 -36.91 76.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.609 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -60.43 -48.59 81.08 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 123.107 0.254 . . . . 0.0 110.538 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 7.8 m -72.21 -40.35 67.89 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.601 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.524 HD12 ' HB2' ' F' ' 41' ' ' SER . 11.3 tp -56.99 -43.45 81.73 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.992 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -77.62 -53.41 7.6 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.765 -179.845 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -37.47 77.16 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.58 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -117.96 82.43 17.29 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-O 120.802 0.334 . . . . 0.0 110.573 -179.318 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -60.75 -32.36 92.9 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.567 2.178 . . . . 0.0 112.225 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 92.9 p -71.59 -28.38 63.78 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 121.131 -0.228 . . . . 0.0 111.225 179.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.79 -4.25 33.76 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.448 0.467 . . . . 0.0 110.874 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.524 ' HB2' HD12 ' F' ' 34' ' ' LEU . 62.5 p -54.56 -41.26 69.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.205 0.526 . . . . 0.0 110.245 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.93 -45.59 91.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.696 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -62.21 -39.74 93.76 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.36 -33.3 75.52 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.702 178.678 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mp -61.7 -37.71 85.14 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.385 0.428 . . . . 0.0 109.976 179.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.35 -52.27 59.21 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.718 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -68.57 -41.13 80.14 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.93 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.1 95.09 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -64.98 -37.56 88.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.088 177.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.43 -38.46 89.82 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.829 179.035 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.424 ' HB2' HD11 ' F' ' 22' ' ' LEU . 25.7 mt -62.52 -39.84 94.83 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.354 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -56.71 -36.04 69.23 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.129 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -78.61 -38.15 40.55 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.56 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.77 72.3 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -93.33 -10.06 36.68 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.544 -179.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 C--O 1.236 0.366 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.865 -179.275 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.416 ' HD2' ' C ' ' C' ' 16' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.73 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.612 HD22 HD21 ' E' ' 34' ' ' LEU . 0.1 OUTLIER -108.05 149.13 28.82 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.29 178.079 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 23.8 t -137.24 134.54 47.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.443 -179.49 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.85 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.9 OUTLIER -100.18 125.05 46.27 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.441 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.431 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 35.6 p90 -134.3 155.21 50.63 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.784 0.678 . . . . 0.0 110.944 179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.34 130.64 56.96 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.756 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -99.51 126.83 45.53 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.787 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -76.59 111.85 12.52 Favored 'General case' 0 CA--C 1.522 -0.11 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD1' ' C' ' 31' ' ' ILE . 11.3 m -118.7 -1.72 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.929 -177.651 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.11 -138.81 41.76 Favored Glycine 0 C--N 1.338 0.646 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -178.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 8.9 t 54.18 -169.83 0.06 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.92 0.391 . . . . 0.0 112.036 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -79.31 -0.06 30.93 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt -89.38 -15.74 32.59 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.284 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.05 -94.21 0.17 Allowed Glycine 0 C--N 1.341 0.822 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 -178.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.41 162.85 26.18 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.533 HG23 ' HB3' ' E' ' 20' ' ' PRO . 56.0 mt -112.01 133.84 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.31 179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.7 mm -83.84 114.59 24.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.389 0.614 . . . . 0.0 109.629 178.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.14 144.5 16.45 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 108.324 -1.91 . . . . 0.0 108.324 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.547 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -124.82 156.63 37.5 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.3 0.571 . . . . 0.0 111.002 -179.59 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . . . . . . . . . 3.7 ptm -105.29 145.11 31.15 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.946 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 21.5 t -118.53 124.65 73.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 O-C-N 123.831 0.707 . . . . 0.0 110.225 -179.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.99 155.77 31.67 Favored Glycine 0 CA--C 1.531 1.048 0 O-C-N 123.424 0.452 . . . . 0.0 112.652 178.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . . . . . . . . . . . -23.08 -76.34 0.01 OUTLIER Glycine 0 N--CA 1.48 1.633 0 C-N-CA 124.517 1.056 . . . . 0.0 113.774 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 p -140.81 147.53 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 117.905 -1.045 . . . . 0.0 111.06 -179.777 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.917 0 CA-C-O 121.169 0.316 . . . . 0.0 112.653 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -98.22 130.64 44.94 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -106.78 126.34 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-O 121.486 0.66 . . . . 0.0 111.106 -179.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.402 HG11 HD21 ' E' ' 45' ' ' LEU . 42.1 t -108.57 144.49 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-N 114.264 -1.335 . . . . 0.0 112.175 -178.541 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -123.59 126.62 46.96 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 22' ' ' LEU . 30.7 mt -122.98 59.7 13.99 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 120.77 0.319 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.533 ' HB3' HG23 ' C' ' 31' ' ' ILE . 56.0 Cg_endo -71.49 -21.33 26.16 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 122.77 2.313 . . . . 0.0 111.294 178.706 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.431 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.7 m-20 -82.91 -4.87 58.69 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.008 -178.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . 0.409 HD22 HD22 ' E' ' 19' ' ' LEU . 10.5 mp -97.99 138.15 35.74 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.558 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -81.53 163.35 54.72 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.672 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.08 -35.04 60.38 Favored 'Trans proline' 0 N--CA 1.501 1.953 0 C-N-CA 122.137 1.891 . . . . 0.0 112.912 -178.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.42 -45.62 86.79 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.41 ' NE2' HD11 ' E' ' 51' ' ' LEU . 26.0 mm100 -67.17 -45.94 75.49 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.289 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.69 -39.82 95.27 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 47.5 t -66.13 -40.9 90.99 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.078 178.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.86 -45.17 93.8 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.674 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -64.95 -48.2 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.552 179.386 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.85 HD11 ' CE2' ' C' ' 19' ' ' PHE . 41.0 mt -62.58 -34.16 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -69.58 -50.31 45.85 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 69.7 m -62.17 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.642 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.612 HD21 HD22 ' C' ' 17' ' ' LEU . 61.4 tp -58.65 -40.89 84.73 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.436 179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -74.63 -47.68 30.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.495 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -58.94 -39.62 82.19 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -124.3 83.2 57.07 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 123.147 0.279 . . . . 0.0 110.959 -178.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -66.49 -32.5 39.68 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.508 2.139 . . . . 0.0 112.24 -179.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 19.0 t -61.38 -35.05 76.39 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.81 179.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -91.68 13.37 18.25 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.379 -179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -47.03 -44.3 20.4 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.76 -47.91 70.74 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.373 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -63.06 -46.19 88.68 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.055 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 77.4 mt -60.15 -40.47 89.96 Favored 'General case' 0 C--O 1.234 0.251 0 O-C-N 123.637 0.586 . . . . 0.0 110.708 -179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.707 HD22 ' CE ' ' E' ' 49' ' ' LYS . 0.8 OUTLIER -64.24 -42.8 96.35 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.41 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.5 -37.62 39.77 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.625 0.578 . . . . 0.0 110.11 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -67.69 -39.12 84.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.235 178.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.48 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.36 -33.06 71.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.577 -178.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.707 ' CE ' HD22 ' E' ' 45' ' ' LEU . 17.0 mttt -66.88 -43.14 84.26 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.792 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -59.55 -35.67 74.69 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 176.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -67.18 -40.31 86.56 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.289 177.999 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.4 t30 -56.58 -38.21 71.66 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -80.27 -32.39 38.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.187 177.672 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -67.09 -30.88 71.04 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.189 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -116.72 10.46 14.31 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.153 0.501 . . . . 0.0 110.871 -178.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.862 -179.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.672 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -74.38 142.51 45.05 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 87.1 mt -116.49 141.81 32.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.248 179.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 12.0 t -126.06 117.82 49.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 -179.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.431 ' CD1' ' CB ' ' C' ' 20' ' ' PHE . 2.4 m-85 -92.93 134.84 34.7 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.462 0.476 . . . . 0.0 110.57 179.637 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' F' ' 22' ' ' LEU . 15.6 mt -122.64 79.02 47.77 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.49 -178.209 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -81.54 -51.23 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 122.854 2.37 . . . . 0.0 113.288 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -82.62 8.02 13.07 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.54 HD21 HD23 ' F' ' 51' ' ' LEU . 0.1 OUTLIER -72.92 138.69 46.32 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.516 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . 0.427 ' H ' HD13 ' F' ' 22' ' ' LEU . 3.5 m-80 -77.14 148.62 78.45 Favored Pre-proline 0 C--N 1.346 0.447 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.59 -43.02 14.31 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.295 1.33 . . . . 0.0 111.752 -179.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -61.24 -37.73 84.1 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.721 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.569 ' HG2' HD21 ' F' ' 51' ' ' LEU . 61.8 tp60 -68.62 -37.66 79.94 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.93 178.29 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.67 -41.55 99.14 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.423 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -57.89 -39.34 77.65 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.08 -40.3 82.73 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.56 178.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.682 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.9 t80 -62.62 -52.76 62.1 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.417 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' F' ' 34' ' ' LEU . 84.3 mt -59.95 -40.06 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 62.7 t-80 -61.5 -45.55 93.74 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.147 179.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . 0.435 ' OG ' HD13 ' F' ' 44' ' ' LEU . 66.8 p -63.46 -38.02 89.54 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.271 -179.663 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.682 HD11 ' CE2' ' F' ' 30' ' ' PHE . 31.5 mt -59.61 -45.03 93.16 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.446 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -70.73 -41.73 71.49 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.705 179.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -58.26 -40.55 82.12 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.025 -179.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -138.33 103.89 7.91 Favored Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.038 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -70.88 -46.08 0.84 Allowed 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 122.426 2.084 . . . . 0.0 112.532 -179.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 90.6 p -60.73 -32.7 71.96 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.221 -179.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -89.15 0.49 56.69 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.386 -179.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.423 ' HA ' HD12 ' F' ' 44' ' ' LEU . 84.0 p -57.98 -36.37 72.52 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 120.765 0.316 . . . . 0.0 110.55 179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.7 -43.39 96.75 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.238 177.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -64.34 -41.51 96.73 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.435 HD13 ' OG ' ' F' ' 33' ' ' SER . 55.4 mt -63.03 -33.56 75.68 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.422 178.551 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.6 mp -63.31 -39.28 94.13 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.968 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.21 -49.56 73.74 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.488 179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' F' ' 51' ' ' LEU . 64.2 mm-40 -68.74 -42.14 77.98 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.87 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.01 -44.67 97.07 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.41 0.624 . . . . 0.0 109.528 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 14.7 ttmt -64.26 -37.23 86.76 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.022 177.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -69.92 -32.63 71.02 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.028 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.569 HD21 ' HG2' ' F' ' 26' ' ' GLN . 14.4 tp -63.24 -38.33 90.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.585 -1.188 . . . . 0.0 109.251 179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -40.68 86.68 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -73.44 -34.72 65.57 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.471 178.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.59 -33.42 71.06 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 112.008 -179.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -98.62 -3.91 35.11 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 123.34 0.4 . . . . 0.0 110.986 -179.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.738 -179.195 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . 0.46 ' HZ2' ' N ' ' C' ' 38' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.455 0 CA-C-O 120.486 0.184 . . . . 0.0 111.236 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.563 ' HG ' HD21 ' E' ' 34' ' ' LEU . 2.1 mm? -100.4 132.34 45.83 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.044 178.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -131.73 134.65 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.824 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.8 OUTLIER -103.57 125.9 50.38 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.45 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.494 ' CD2' ' CZ ' ' F' ' 18' ' ' TYR . 38.2 p90 -136.86 154.94 50.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.347 -179.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -112.4 137.48 50.52 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.141 178.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . 0.494 ' O ' HG13 ' C' ' 24' ' ' VAL . 35.9 tt0 -108.16 118.45 36.79 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.887 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -69.23 128.43 36.6 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.448 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.621 HG11 ' CG1' ' C' ' 31' ' ' ILE . 16.5 m -115.07 3.6 7.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.667 -176.654 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.01 -45.82 0.73 Allowed Glycine 0 CA--C 1.532 1.11 0 O-C-N 123.268 0.355 . . . . 0.0 113.065 178.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 15.5 m -56.34 166.49 0.84 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.939 0.399 . . . . 0.0 111.292 -179.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -53.39 -24.34 12.08 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.931 179.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -55.1 -27.97 49.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.228 -0.897 . . . . 0.0 111.422 179.475 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . 0.592 ' O ' HG22 ' C' ' 24' ' ' VAL . . . 89.1 -98.99 2.51 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -134.74 168.62 18.69 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.448 0.165 . . . . 0.0 110.625 179.473 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.621 ' CG1' HG11 ' C' ' 24' ' ' VAL . 0.9 OUTLIER -117.54 137.3 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.266 -0.425 . . . . 0.0 109.958 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 2.2 mm -83.94 118.78 31.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.04 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -140.49 150.48 21.66 Favored Glycine 0 N--CA 1.454 -0.149 0 N-CA-C 108.573 -1.811 . . . . 0.0 108.573 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.689 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -126.93 157.6 39.01 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.516 0.674 . . . . 0.0 112.084 -179.356 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.532 ' SD ' ' HE2' ' F' ' 18' ' ' TYR . 5.8 mtp -107.23 142.84 36.34 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.194 -1.366 . . . . 0.0 109.804 179.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 10.7 t -121.34 130.45 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 O-C-N 123.787 0.68 . . . . 0.0 111.31 -178.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 56.29 32.87 60.83 Favored Glycine 0 C--N 1.347 1.146 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 179.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . 0.46 ' N ' ' HZ2' ' C' ' 16' ' ' LYS . . . -89.6 -170.77 44.72 Favored Glycine 0 C--N 1.331 0.261 0 CA-C-O 121.408 0.449 . . . . 0.0 112.087 -179.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -137.02 133.46 47.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 114.373 -0.913 . . . . 0.0 110.055 -179.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.467 0.417 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.924 -179.929 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.738 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -83.4 128.77 34.78 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.93 125.63 71.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 121.014 0.435 . . . . 0.0 109.871 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 145.2 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.17 -178.314 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -126.38 128.03 46.41 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.233 178.013 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 70.1 mt -122.72 61.66 16.52 Favored Pre-proline 0 CA--C 1.542 0.659 0 O-C-N 123.353 0.408 . . . . 0.0 110.558 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.431 ' HB3' ' CG2' ' C' ' 31' ' ' ILE . 59.6 Cg_endo -72.31 -21.56 23.01 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 122.888 2.392 . . . . 0.0 111.95 179.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.406 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 76.9 m-20 -87.38 0.69 55.09 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.278 -178.191 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -99.51 135.5 40.83 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.07 0.462 . . . . 0.0 111.422 -179.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . 0.498 HD22 HE22 ' E' ' 55' ' ' GLN . 2.0 m-80 -74.87 162.95 71.38 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.643 179.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.98 -34.34 66.7 Favored 'Trans proline' 0 N--CA 1.499 1.851 0 C-N-CA 122.016 1.811 . . . . 0.0 111.49 179.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -63.61 -46.47 85.62 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.827 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . 0.443 ' NE2' HD11 ' E' ' 51' ' ' LEU . 29.3 mm100 -66.2 -46.78 76.1 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.128 -179.708 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 93.7 mt -63.42 -44.7 93.85 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.66 -43.5 96.54 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.367 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.91 92.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.44 179.735 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' E' ' 48' ' ' ALA . 37.6 t80 -64.74 -49.33 71.22 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.746 179.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.824 HD11 ' CE2' ' C' ' 19' ' ' PHE . 54.2 mt -59.24 -32.42 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.642 -179.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -50.23 63.97 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.52 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 22.7 t -67.6 -44.34 78.33 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.624 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.563 HD21 ' HG ' ' C' ' 17' ' ' LEU . 32.9 tp -54.7 -37.93 66.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.96 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -82.72 -35.23 26.88 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.546 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -60.69 -42.26 96.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.13 -178.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -135.27 81.98 42.38 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-O 120.893 0.378 . . . . 0.0 111.138 -179.034 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -60.51 -27.74 85.39 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.665 2.243 . . . . 0.0 112.283 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 10.8 t -60.94 -37.46 82.43 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.32 9.38 38.38 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.909 179.231 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.1 p -47.82 -37.96 14.88 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.077 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.0 66.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.69 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -62.92 -43.93 97.45 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.058 179.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 66.6 mt -61.77 -39.75 92.74 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.082 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.47 HD23 ' HB3' ' E' ' 48' ' ' ALA . 0.4 OUTLIER -65.69 -36.46 83.7 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.526 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.85 -36.45 67.54 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -68.12 -41.95 80.96 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.901 179.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.51 ' HA ' ' HB2' ' E' ' 51' ' ' LEU . . . -70.77 -32.68 69.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.762 -179.16 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . 0.461 ' HE2' HD22 ' E' ' 45' ' ' LEU . 0.0 OUTLIER -68.01 -44.11 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.475 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -62.74 -33.54 75.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 176.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.51 ' HB2' ' HA ' ' E' ' 48' ' ' ALA . 0.2 OUTLIER -66.6 -39.7 88.5 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.53 177.406 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -56.19 -40.65 74.29 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 115.258 -0.883 . . . . 0.0 108.769 179.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . 0.505 ' HA ' ' HB2' ' E' ' 56' ' ' ALA . 70.0 m-20 -80.09 -28.46 39.09 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.338 177.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.74 -25.58 65.71 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.676 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . 0.498 HE22 HD22 ' E' ' 23' ' ' ASN . 20.0 mt-30 -121.89 8.07 9.9 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 123.599 0.562 . . . . 0.0 110.555 -179.458 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.505 ' HB2' ' HA ' ' E' ' 53' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-N 114.946 -1.025 . . . . 0.0 112.07 -179.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.555 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.64 145.38 52.48 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.423 -0.389 . . . . 0.0 110.018 179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 77.5 mt -116.97 141.44 35.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.195 179.129 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 13.9 t -125.97 116.69 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.321 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.532 ' HE2' ' SD ' ' C' ' 35' ' ' MET . 3.1 m-85 -96.42 135.53 38.16 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.469 0.48 . . . . 0.0 110.887 179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -121.22 72.71 26.23 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.909 -178.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -79.72 -50.7 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.773 0 C-N-CA 123.025 2.483 . . . . 0.0 113.451 -179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -82.18 2.8 29.91 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' F' ' 26' ' ' GLN . 0.4 OUTLIER -74.84 151.89 38.99 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -93.53 150.82 39.5 Favored Pre-proline 0 N--CA 1.467 0.401 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -54.42 -34.36 80.94 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 122.029 1.819 . . . . 0.0 112.751 -178.609 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.65 -42.67 88.9 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.534 ' HB3' HD21 ' F' ' 22' ' ' LEU . 1.6 mm100 -68.19 -38.28 81.84 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 114.775 -1.102 . . . . 0.0 110.307 178.366 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' F' ' 27' ' ' LEU . 45.4 mt -63.25 -46.29 87.58 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 123.089 0.243 . . . . 0.0 110.599 179.293 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 11.7 t -60.29 -47.6 85.32 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.223 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.63 -39.98 95.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.929 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.571 ' CZ ' HD11 ' F' ' 34' ' ' LEU . 24.2 t80 -62.79 -53.95 46.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.48 -179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -59.36 -36.27 63.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 O-C-N 123.38 0.425 . . . . 0.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -62.79 -41.98 99.5 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 20.0 m -64.92 -40.81 95.64 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.422 179.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.571 HD11 ' CZ ' ' F' ' 30' ' ' PHE . 75.8 mt -58.76 -37.29 75.91 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 179.766 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -81.54 -36.6 28.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.1 -179.233 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -59.24 -38.44 80.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 121.287 -0.165 . . . . 0.0 111.273 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -150.21 95.14 3.63 Favored Pre-proline 0 CA--C 1.537 0.45 0 O-C-N 123.519 0.512 . . . . 0.0 109.839 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_exo -49.66 -39.21 46.9 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.046 2.498 . . . . 0.0 113.555 -179.3 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -63.19 -38.01 89.47 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.156 -179.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -67.23 -19.27 65.51 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . . . . . . . . . 91.4 p -47.14 -42.05 18.73 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.07 -51.25 69.96 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.496 0.498 . . . . 0.0 110.887 179.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -64.64 -41.24 96.28 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . . . . . . . . . 36.4 mt -61.08 -34.63 75.22 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.78 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.13 -37.61 83.44 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.107 179.172 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.91 -59.28 4.71 Favored 'General case' 0 C--N 1.334 -0.072 0 O-C-N 123.472 0.482 . . . . 0.0 110.461 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -62.07 -40.35 95.49 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.068 0.23 . . . . 0.0 111.077 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -41.19 91.15 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -67.78 -39.14 84.11 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.379 178.122 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -61.76 -35.14 77.27 Favored 'General case' 0 C--N 1.348 0.534 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 179.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' F' ' 51' ' ' LEU . 31.5 mt -61.81 -39.66 92.52 Favored 'General case' 0 CA--C 1.513 -0.46 0 O-C-N 123.137 0.273 . . . . 0.0 110.347 178.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.499 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 0.0 OUTLIER -57.15 -36.72 71.07 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 179.062 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -78.1 -36.35 48.15 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.413 178.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.08 70.28 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.697 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -93.78 -11.47 31.24 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.866 -179.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.451 -0.416 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.98 -178.83 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.821 0.343 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.79 147.06 45.09 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.577 179.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 18' ' ' VAL . . . . . . . . . . . . . 5.2 t -141.04 136.26 33.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.105 -178.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 19' ' ' PHE . . . . . 0.895 ' CE2' HD11 ' E' ' 31' ' ' ILE . 0.4 OUTLIER -101.03 130.19 47.0 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 179.246 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.404 ' CB ' ' CD1' ' F' ' 18' ' ' TYR . 51.3 p90 -142.32 157.12 45.16 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 123.623 0.577 . . . . 0.0 111.488 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.64 136.24 54.95 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 178.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -115.15 131.75 56.83 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.133 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -71.73 120.74 17.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.635 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 24' ' ' VAL . . . . . 0.442 HG11 HG13 ' C' ' 31' ' ' ILE . 18.7 m -120.52 32.63 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.182 -177.885 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . 17.52 68.42 0.01 OUTLIER Glycine 0 N--CA 1.483 1.833 0 C-N-CA 124.529 1.062 . . . . 0.0 114.298 178.049 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 26' ' ' SER . . . . . . . . . . . . . 72.1 p -163.47 179.37 7.33 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 27' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -55.85 -25.57 42.7 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.421 0.629 . . . . 0.0 109.885 178.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -63.08 -27.89 69.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.058 178.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.77 -97.78 1.02 Allowed Glycine 0 C--N 1.34 0.796 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -177.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.0 158.24 37.46 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 31' ' ' ILE . . . . . 0.521 HG23 ' HB3' ' E' ' 20' ' ' PRO . 3.6 mt -109.81 129.35 64.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.25 -179.237 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 32' ' ' ILE . . . . . 0.488 ' HA ' HD13 ' C' ' 32' ' ' ILE . 1.4 mm -80.78 118.16 28.03 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.03 151.91 21.58 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 178.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.543 HD22 ' CZ ' ' C' ' 19' ' ' PHE . 0.3 OUTLIER -127.99 151.07 49.58 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.556 0.693 . . . . 0.0 110.888 -179.784 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 35' ' ' MET . . . . . 0.407 ' HE2' ' HA3' ' C' ' 38' ' ' GLY . 0.3 OUTLIER -97.48 145.01 26.62 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 113.99 -1.459 . . . . 0.0 109.158 -179.887 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 15.8 t -126.22 123.03 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 37' ' ' GLY . . . . . . . . . . . . . . . 53.91 41.95 68.84 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 38' ' ' GLY . . . . . 0.407 ' HA3' ' HE2' ' C' ' 35' ' ' MET . . . -93.7 -164.11 36.71 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.193 -0.504 . . . . 0.0 112.555 -178.338 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.27 125.43 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 114.797 -0.701 . . . . 0.0 110.319 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.629 179.24 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' E' E ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.744 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' E' E ' 15' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -75.28 122.8 24.26 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 16' ' ' ILE . . . . . . . . . . . . . 1.4 mt -107.4 126.78 63.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.409 0.623 . . . . 0.0 110.48 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 17' ' ' VAL . . . . . 0.514 HG21 HD21 ' E' ' 45' ' ' LEU . 54.4 t -107.53 147.05 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.029 -177.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 18' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -127.24 126.85 43.44 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.413 178.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . . . . . . . . . 58.9 mt -124.03 48.46 2.31 Favored Pre-proline 0 CA--C 1.546 0.808 0 O-C-N 123.35 0.406 . . . . 0.0 111.997 -179.233 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 20' ' ' PRO . . . . . 0.521 ' HB3' HG23 ' C' ' 31' ' ' ILE . 25.7 Cg_endo -64.89 -17.07 58.39 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.738 1.625 . . . . 0.0 111.069 178.506 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 21' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' E' ' 56' ' ' ALA . 75.7 m-20 -82.71 -5.66 58.99 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.453 -179.195 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 22' ' ' LEU . . . . . . . . . . . . . 10.1 mp -96.95 134.89 39.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.979 0.419 . . . . 0.0 110.604 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -68.16 159.97 77.4 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.569 179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 24' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -53.18 -32.61 60.66 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.811 1.674 . . . . 0.0 110.782 179.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -65.8 -48.62 71.14 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.538 178.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -62.63 -43.52 98.59 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.73 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 27' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.8 -43.02 89.95 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.152 179.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 28' ' ' CYS . . . . . . . . . . . . . 57.4 m -64.24 -38.7 91.99 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.69 -44.02 94.9 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 30' ' ' PHE . . . . . 0.877 ' CE2' HD11 ' E' ' 34' ' ' LEU . 53.6 t80 -66.12 -53.62 35.61 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.441 179.807 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 31' ' ' ILE . . . . . 0.895 HD11 ' CE2' ' C' ' 19' ' ' PHE . 26.8 mt -56.74 -39.14 61.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.46 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 32' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -66.59 -43.33 85.16 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . . . . . . . . . 59.5 m -64.01 -44.58 92.17 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.36 -179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 34' ' ' LEU . . . . . 0.877 HD11 ' CE2' ' E' ' 30' ' ' PHE . 89.6 mt -59.07 -44.13 91.84 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.404 0.621 . . . . 0.0 110.418 179.704 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 35' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -35.48 78.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.843 -178.466 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 36' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -62.44 -41.28 98.62 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 121.268 -0.173 . . . . 0.0 111.369 179.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -145.67 80.37 10.7 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.852 -179.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 38' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.58 -24.38 53.47 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 122.233 1.955 . . . . 0.0 112.156 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 39' ' ' SER . . . . . . . . . . . . . 77.2 p -62.43 -36.66 83.09 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.458 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.81 8.76 35.66 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.262 179.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . . . . . . . . . 93.9 p -54.42 -36.83 64.42 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.89 -48.02 78.32 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 121.095 -0.242 . . . . 0.0 110.865 -179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 43' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -66.76 -47.74 71.28 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.668 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -58.34 -41.88 85.64 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.694 0.621 . . . . 0.0 110.611 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 45' ' ' LEU . . . . . 0.514 HD21 HG21 ' E' ' 17' ' ' VAL . 19.7 tp -63.93 -33.54 75.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.39 179.242 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.07 -36.21 74.68 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.149 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -70.93 -39.3 72.73 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.932 178.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 48' ' ' ALA . . . . . 0.457 ' HB2' ' CD1' ' E' ' 30' ' ' PHE . . . -70.0 -32.65 70.94 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.46 -179.394 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -40.72 85.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.158 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 50' ' ' LYS . . . . . . . . . . . . . 20.5 mtpp -64.42 -34.13 77.48 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 51' ' ' LEU . . . . . 0.489 ' HA ' ' HB3' ' E' ' 54' ' ' ALA . 0.4 OUTLIER -66.23 -38.89 88.99 Favored 'General case' 0 C--N 1.345 0.379 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' E' E ' 52' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' E' ' 56' ' ' ALA . 42.0 t30 -55.38 -40.21 71.07 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.934 179.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 53' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.6 -32.49 36.38 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.243 177.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 54' ' ' ALA . . . . . 0.489 ' HB3' ' HA ' ' E' ' 51' ' ' LEU . . . -65.87 -29.87 70.39 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.98 -179.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' E' E ' 55' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -118.4 9.62 12.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.087 0.47 . . . . 0.0 110.966 -178.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' E' E ' 56' ' ' ALA . . . . . 0.471 ' HB2' ' O ' ' E' ' 52' ' ' ASN . . . . . . . . 0 N--CA 1.445 -0.68 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.818 -179.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.556 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' F' F ' 15' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.39 143.53 57.67 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 16' ' ' ILE . . . . . . . . . . . . . 31.1 mt -117.83 143.96 27.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.119 179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 17' ' ' VAL . . . . . . . . . . . . . 24.0 t -127.1 121.56 58.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.85 -178.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 18' ' ' TYR . . . . . 0.44 ' C ' HD22 ' F' ' 19' ' ' LEU . 4.6 m-85 -99.47 138.94 35.85 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.412 0.445 . . . . 0.0 110.272 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 19' ' ' LEU . . . . . 0.925 HD12 HD13 ' F' ' 22' ' ' LEU . 3.2 mm? -118.49 77.33 13.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.272 -179.024 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.33 -62.68 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.313 0 C-N-CA 122.703 2.269 . . . . 0.0 111.745 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 21' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -61.26 -27.54 68.53 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.336 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 22' ' ' LEU . . . . . 0.925 HD13 HD12 ' F' ' 19' ' ' LEU . 0.3 OUTLIER -53.97 148.3 10.86 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.57 -179.014 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' F' F ' 23' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -82.7 152.78 67.05 Favored Pre-proline 0 N--CA 1.466 0.344 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 179.295 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 24' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.44 -35.41 49.62 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.647 1.565 . . . . 0.0 111.036 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -61.32 -39.41 90.43 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.686 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 26' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' F' ' 51' ' ' LEU . 9.3 tp-100 -66.92 -39.45 87.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.669 178.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 27' ' ' LEU . . . . . . . . . . . . . 18.4 mt -61.01 -43.04 99.48 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.044 178.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 28' ' ' CYS . . . . . . . . . . . . . 35.0 t -60.3 -46.63 89.2 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.301 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.58 178.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 30' ' ' PHE . . . . . 0.676 ' CE2' HD11 ' F' ' 34' ' ' LEU . 29.0 t80 -61.67 -52.82 62.77 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.397 179.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 31' ' ' ILE . . . . . 0.474 ' HA ' HD12 ' F' ' 34' ' ' LEU . 94.5 mt -59.78 -38.98 78.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.687 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 32' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -62.6 -38.61 90.86 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 178.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 33' ' ' SER . . . . . . . . . . . . . 19.4 m -66.72 -42.44 86.35 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.582 179.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 34' ' ' LEU . . . . . 0.676 HD11 ' CE2' ' F' ' 30' ' ' PHE . 45.8 mt -59.99 -44.26 94.62 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.966 0.413 . . . . 0.0 109.925 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 35' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -68.94 -45.93 69.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.165 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 36' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.63 -42.87 93.68 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.749 -178.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 37' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -131.42 90.18 38.51 Favored Pre-proline 0 CA--C 1.54 0.58 0 O-C-N 123.265 0.353 . . . . 0.0 110.861 -179.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 38' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -62.08 -44.33 20.39 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.142 1.895 . . . . 0.0 112.215 -179.73 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -62.6 -32.39 73.38 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.377 -179.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 40' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -91.55 1.17 57.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 123.339 0.399 . . . . 0.0 110.725 -179.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 41' ' ' SER . . . . . 0.446 ' HA ' HD12 ' F' ' 44' ' ' LEU . 86.3 p -54.73 -39.84 68.66 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.745 0.307 . . . . 0.0 110.729 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.72 -43.79 97.89 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.829 178.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 43' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.96 -39.5 94.3 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.597 178.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 44' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' F' ' 41' ' ' SER . 55.5 mt -64.0 -33.65 76.21 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.539 178.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 45' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.14 -39.84 95.86 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.687 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.08 -48.95 76.43 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.411 179.613 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 47' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -69.56 -40.55 76.72 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.249 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.85 -48.22 79.97 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 49' ' ' LYS . . . . . . . . . . . . . 17.4 ttpt -63.76 -35.33 80.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.23 177.646 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 50' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.33 -36.17 76.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 51' ' ' LEU . . . . . 0.464 HD23 ' HG2' ' F' ' 26' ' ' GLN . 12.0 tp -63.72 -39.71 94.96 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.332 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 52' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' F' ' 56' ' ' ALA . 8.7 t30 -58.25 -38.45 76.92 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' F' F ' 53' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -72.95 -35.86 67.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.278 177.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.19 72.4 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.736 -179.567 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 55' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -93.39 -3.78 52.63 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.67 -179.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' F' F ' 56' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' F' ' 52' ' ' ASN . . . . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.621 -179.549 . . . . . . . . 1 1 . 1 stop_ save_