data_1f62_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 1f62 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 . . . . . 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -69.45 135.73 88.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -69.7 153.32 69.33 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.549 2.833 . . . . 0.0 111.144 -169.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.23 68.5 5.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.841 0.856 . . . . 0.0 110.018 173.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.7 p . . . . . 0 C--O 1.253 1.272 0 CA-C-O 116.933 -1.508 . . . . 0.0 108.587 175.262 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -109.21 102.56 49.57 Favored Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_exo -58.36 84.88 0.05 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.847 3.031 . . . . 0.0 112.606 169.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -170.84 159.77 6.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.056 1.342 . . . . 0.0 109.032 -169.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.05 1.34 . . . . 0.0 109.208 169.67 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -129.93 80.65 70.8 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.43 -56.61 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.791 2.327 . . . . 0.0 110.504 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.94 67.46 0.54 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.373 -1.298 . . . . 0.0 108.249 -169.544 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -73.92 133.21 79.2 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -58.92 127.78 25.58 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.412 2.075 . . . . 0.0 112.109 169.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.14 137.84 12.07 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.914 -170.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.394 -1.289 . . . . 0.0 108.391 -178.985 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -119.85 88.75 40.71 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -63.56 83.41 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.984 2.456 . . . . 0.0 112.06 169.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.71 67.42 2.8 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.56 1.144 . . . . 0.0 109.86 171.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 p . . . . . 0 C--O 1.251 1.136 0 C-N-CA 125.178 1.391 . . . . 0.0 108.367 -169.874 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -165.01 133.36 2.57 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -78.48 73.1 6.02 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.669 2.246 . . . . 0.0 108.317 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.06 159.16 33.4 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.02 0.928 . . . . 0.0 111.905 -169.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.352 1.461 . . . . 0.0 109.35 -178.968 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -113.02 78.14 2.92 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -84.37 178.09 5.36 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.753 2.302 . . . . 0.0 109.283 169.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.13 94.45 1.53 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 116.848 -1.548 . . . . 0.0 110.174 175.395 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -74.84 125.65 89.22 Favored Pre-proline 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -79.88 69.5 7.91 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.349 2.032 . . . . 0.0 110.332 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.61 149.52 11.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.931 1.292 . . . . 0.0 108.948 169.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.252 1.195 0 CA-C-O 117.627 -1.178 . . . . 0.0 110.454 178.773 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -92.65 118.04 67.82 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -43.21 146.42 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 124.811 3.674 . . . . 0.0 115.444 -169.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -51.92 110.28 0.46 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.909 1.283 . . . . 0.0 111.015 175.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.373 -1.775 . . . . 0.0 106.857 -171.554 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -132.23 109.91 13.9 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -49.55 131.29 27.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.78 2.987 . . . . 0.0 112.743 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.65 111.9 2.28 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.718 0.807 . . . . 0.0 109.726 174.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.105 -1.426 . . . . 0.0 109.188 169.845 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -76.7 147.45 78.09 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.31 60.14 7.25 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.167 2.578 . . . . 0.0 109.739 172.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -172.36 -178.71 2.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.048 1.339 . . . . 0.0 109.101 -169.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 48.2 m . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.44 -1.267 . . . . 0.0 108.469 169.951 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -116.53 79.79 9.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.39 72.8 5.82 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.238 2.626 . . . . 0.0 110.219 173.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.99 151.76 44.3 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.01 176.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.053 -1.451 . . . . 0.0 108.495 171.615 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -69.93 159.41 84.27 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -68.99 72.51 1.07 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.044 1.829 . . . . 0.0 111.424 168.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.31 -178.34 6.26 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.025 1.33 . . . . 0.0 109.262 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 116.883 -1.532 . . . . 0.0 108.876 -177.539 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -81.2 154.24 72.09 Favored Pre-proline 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -62.89 160.22 34.42 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 122.042 1.828 . . . . 0.0 112.619 169.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.45 77.0 1.92 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.565 169.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.976 173.273 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -69.07 110.92 6.98 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.77 -48.02 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.376 2.051 . . . . 0.0 110.462 -172.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.77 59.14 0.54 Allowed 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.682 1.193 . . . . 0.0 108.358 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.993 1.317 . . . . 0.0 109.069 -177.705 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -132.53 92.21 28.27 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -77.3 171.54 17.56 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.841 2.361 . . . . 0.0 110.644 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.7 142.05 57.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.057 0.543 . . . . 0.0 109.907 169.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 117.071 -1.442 . . . . 0.0 108.244 178.976 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.61 161.47 74.04 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -84.52 -52.99 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.934 2.423 . . . . 0.0 110.784 169.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.09 151.99 18.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.336 1.054 . . . . 0.0 108.969 -175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.0 p . . . . . 0 C--O 1.252 1.185 0 CA-C-O 116.885 -1.531 . . . . 0.0 109.229 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -69.44 133.46 89.1 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -59.22 129.31 30.96 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.638 2.225 . . . . 0.0 112.213 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.46 153.96 35.65 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.291 1.037 . . . . 0.0 109.12 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.268 -1.349 . . . . 0.0 108.356 177.678 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -69.99 147.32 95.8 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.73 171.23 18.58 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.365 2.71 . . . . 0.0 110.726 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.61 58.45 4.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.982 0.913 . . . . 0.0 110.496 -175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.337 1.455 . . . . 0.0 109.349 179.774 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -77.08 162.12 70.89 Favored Pre-proline 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -62.06 107.06 0.51 Allowed 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.544 2.163 . . . . 0.0 111.315 169.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.91 69.05 2.5 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.939 0.895 . . . . 0.0 109.836 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.964 -1.493 . . . . 0.0 108.648 -169.909 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' H ' HD22 ' A' ' 27' ' ' LEU . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 . . . . . 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -69.45 135.73 88.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -69.7 153.32 69.33 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.549 2.833 . . . . 0.0 111.144 -169.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.23 68.5 5.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.841 0.856 . . . . 0.0 110.018 173.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.7 p . . . . . 0 C--O 1.253 1.272 0 CA-C-O 116.933 -1.508 . . . . 0.0 108.587 175.262 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -109.21 102.56 49.57 Favored Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_exo -58.36 84.88 0.05 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.847 3.031 . . . . 0.0 112.606 169.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -170.84 159.77 6.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.056 1.342 . . . . 0.0 109.032 -169.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.05 1.34 . . . . 0.0 109.208 169.67 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -129.93 80.65 70.8 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.43 -56.61 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.791 2.327 . . . . 0.0 110.504 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.94 67.46 0.54 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.373 -1.298 . . . . 0.0 108.249 -169.544 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -73.92 133.21 79.2 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -58.92 127.78 25.58 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.412 2.075 . . . . 0.0 112.109 169.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.14 137.84 12.07 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.914 -170.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.394 -1.289 . . . . 0.0 108.391 -178.985 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -119.85 88.75 40.71 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -63.56 83.41 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.984 2.456 . . . . 0.0 112.06 169.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.71 67.42 2.8 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.56 1.144 . . . . 0.0 109.86 171.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 p . . . . . 0 C--O 1.251 1.136 0 C-N-CA 125.178 1.391 . . . . 0.0 108.367 -169.874 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -165.01 133.36 2.57 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -78.48 73.1 6.02 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.669 2.246 . . . . 0.0 108.317 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.06 159.16 33.4 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.02 0.928 . . . . 0.0 111.905 -169.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.352 1.461 . . . . 0.0 109.35 -178.968 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -113.02 78.14 2.92 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -84.37 178.09 5.36 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.753 2.302 . . . . 0.0 109.283 169.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.13 94.45 1.53 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 116.848 -1.548 . . . . 0.0 110.174 175.395 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' H ' HD22 ' A' ' 27' ' ' LEU . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -74.84 125.65 89.22 Favored Pre-proline 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -79.88 69.5 7.91 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.349 2.032 . . . . 0.0 110.332 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.61 149.52 11.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.931 1.292 . . . . 0.0 108.948 169.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.252 1.195 0 CA-C-O 117.627 -1.178 . . . . 0.0 110.454 178.773 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -92.65 118.04 67.82 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -43.21 146.42 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 124.811 3.674 . . . . 0.0 115.444 -169.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -51.92 110.28 0.46 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.909 1.283 . . . . 0.0 111.015 175.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.373 -1.775 . . . . 0.0 106.857 -171.554 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -132.23 109.91 13.9 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -49.55 131.29 27.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.78 2.987 . . . . 0.0 112.743 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.65 111.9 2.28 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.718 0.807 . . . . 0.0 109.726 174.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.105 -1.426 . . . . 0.0 109.188 169.845 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -76.7 147.45 78.09 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.31 60.14 7.25 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.167 2.578 . . . . 0.0 109.739 172.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -172.36 -178.71 2.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.048 1.339 . . . . 0.0 109.101 -169.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 48.2 m . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.44 -1.267 . . . . 0.0 108.469 169.951 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -116.53 79.79 9.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.39 72.8 5.82 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.238 2.626 . . . . 0.0 110.219 173.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.99 151.76 44.3 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.01 176.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.053 -1.451 . . . . 0.0 108.495 171.615 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -69.93 159.41 84.27 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -68.99 72.51 1.07 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.044 1.829 . . . . 0.0 111.424 168.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.31 -178.34 6.26 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.025 1.33 . . . . 0.0 109.262 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 116.883 -1.532 . . . . 0.0 108.876 -177.539 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -81.2 154.24 72.09 Favored Pre-proline 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -62.89 160.22 34.42 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 122.042 1.828 . . . . 0.0 112.619 169.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.45 77.0 1.92 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.565 169.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.976 173.273 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -69.07 110.92 6.98 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.77 -48.02 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.376 2.051 . . . . 0.0 110.462 -172.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.77 59.14 0.54 Allowed 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.682 1.193 . . . . 0.0 108.358 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.993 1.317 . . . . 0.0 109.069 -177.705 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -132.53 92.21 28.27 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -77.3 171.54 17.56 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.841 2.361 . . . . 0.0 110.644 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.7 142.05 57.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.057 0.543 . . . . 0.0 109.907 169.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 117.071 -1.442 . . . . 0.0 108.244 178.976 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.61 161.47 74.04 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -84.52 -52.99 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.934 2.423 . . . . 0.0 110.784 169.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.09 151.99 18.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.336 1.054 . . . . 0.0 108.969 -175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.0 p . . . . . 0 C--O 1.252 1.185 0 CA-C-O 116.885 -1.531 . . . . 0.0 109.229 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -69.44 133.46 89.1 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -59.22 129.31 30.96 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.638 2.225 . . . . 0.0 112.213 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.46 153.96 35.65 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.291 1.037 . . . . 0.0 109.12 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.268 -1.349 . . . . 0.0 108.356 177.678 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -69.99 147.32 95.8 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.73 171.23 18.58 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.365 2.71 . . . . 0.0 110.726 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.61 58.45 4.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.982 0.913 . . . . 0.0 110.496 -175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.337 1.455 . . . . 0.0 109.349 179.774 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -77.08 162.12 70.89 Favored Pre-proline 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -62.06 107.06 0.51 Allowed 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.544 2.163 . . . . 0.0 111.315 169.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.91 69.05 2.5 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.939 0.895 . . . . 0.0 109.836 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.964 -1.493 . . . . 0.0 108.648 -169.909 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.402 HD21 HE22 ' A' ' 48' ' ' GLN . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.402 HE22 HD21 ' A' ' 30' ' ' LEU . 70.9 mt-30 . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' H ' HD22 ' A' ' 27' ' ' LEU . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 . . . . . 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 . . . . . 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.909 -0.034 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -137.61 159.61 41.48 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.484 1.113 . . . . 0.0 110.142 169.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 t -158.98 132.13 7.16 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.83 1.652 . . . . 0.0 106.553 -169.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -68.93 -24.22 64.26 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.629 0.649 . . . . 0.0 112.192 -169.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.86 -71.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.067 0.947 . . . . 0.0 110.778 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 p -87.38 -33.43 19.13 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.017 0.527 . . . . 0.0 112.1 -169.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.2 mtm-85 58.17 51.61 8.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 125.396 1.478 . . . . 0.0 110.253 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -145.15 141.69 28.96 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.812 1.245 . . . . 0.0 108.46 -169.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -94.42 131.59 39.93 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 169.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.02 -68.13 0.1 OUTLIER Glycine 0 C--N 1.337 0.607 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 172.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.95 55.98 3.28 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.407 1.083 . . . . 0.0 109.899 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.77 58.31 4.57 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.263 1.425 . . . . 0.0 110.655 -169.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -79.2 -80.45 0.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.933 0.893 . . . . 0.0 109.904 -169.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -151.54 75.38 1.16 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 124.654 1.181 . . . . 0.0 108.062 -170.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.79 156.87 38.37 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.076 0.465 . . . . 0.0 110.783 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 tt -133.88 127.38 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.815 1.646 . . . . 0.0 108.294 -171.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -92.79 138.92 31.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 32.6 t -69.71 121.18 16.67 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 169.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.59 -45.42 73.58 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.674 0.789 . . . . 0.0 111.205 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -62.19 -61.19 2.64 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.64 1.176 . . . . 0.0 111.144 -171.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.7 p -120.34 18.44 12.19 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.408 1.083 . . . . 0.0 113.501 -169.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 48.26 41.28 15.8 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.716 1.607 . . . . 0.0 114.093 169.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -90.36 119.82 30.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.398 0.679 . . . . 0.0 109.366 169.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.84 132.2 42.3 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.119 0.968 . . . . 0.0 110.334 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -143.67 143.01 31.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.427 1.491 . . . . 0.0 108.752 -169.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -80.19 154.82 27.72 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 167.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.2 mt -58.34 -42.54 87.08 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.417 169.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -50.22 -56.26 11.86 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.542 1.137 . . . . 0.0 112.326 170.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.0 m -69.93 -32.45 70.73 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.9 0.88 . . . . 0.0 111.207 -172.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.402 HD21 HE22 ' A' ' 48' ' ' GLN . 6.2 tt -59.34 -55.8 30.11 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.393 1.077 . . . . 0.0 109.61 170.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.0 ttm105 -157.54 122.69 2.35 Favored Pre-proline 0 CA--C 1.533 0.321 0 C-N-CA 124.168 0.987 . . . . 0.0 108.367 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -61.62 -28.51 82.81 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.367 2.711 . . . . 0.0 113.257 -169.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.87 -22.32 58.73 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.099 0.96 . . . . 0.0 112.956 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 30.2 tp -84.76 125.49 32.6 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.045 0.938 . . . . 0.0 109.81 -169.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -128.98 -27.24 2.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.733 1.213 . . . . 0.0 111.805 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -108.53 159.19 16.89 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 124.426 1.091 . . . . 0.0 110.127 175.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.25 134.31 80.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.556 0.742 . . . . 0.0 109.416 -169.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -90.03 102.71 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 122.538 2.158 . . . . 0.0 108.891 169.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -75.37 67.28 1.92 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 110.069 171.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.32 -63.33 0.1 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 -172.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -78.41 68.44 4.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.858 0.863 . . . . 0.0 109.546 174.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -81.85 64.42 6.53 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 169.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -143.38 173.65 11.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.284 1.034 . . . . 0.0 110.487 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.6 p -123.3 160.46 50.16 Favored Pre-proline 0 CA--C 1.539 0.532 0 C-N-CA 125.478 1.511 . . . . 0.0 108.149 169.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.62 -34.11 25.97 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 124.67 3.58 . . . . 0.0 115.897 -169.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.02 -41.78 86.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.377 0.671 . . . . 0.0 110.228 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.4 m -78.78 -27.58 44.55 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.284 1.034 . . . . 0.0 111.606 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.402 HE22 HD21 ' A' ' 30' ' ' LEU . 70.9 mt-30 -69.45 135.73 88.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 123.5 0.72 . . . . 0.0 109.707 -178.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -69.7 153.32 69.33 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.549 2.833 . . . . 0.0 111.144 -169.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.23 68.5 5.23 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.841 0.856 . . . . 0.0 110.018 173.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.7 p . . . . . 0 C--O 1.253 1.272 0 CA-C-O 116.933 -1.508 . . . . 0.0 108.587 175.262 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.62 155.49 41.14 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.029 0.932 . . . . 0.0 109.419 -169.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 36.4 t -150.18 146.4 26.84 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.432 1.093 . . . . 0.0 109.024 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -66.05 -49.79 66.43 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.165 0.586 . . . . 0.0 110.84 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.4 t -65.36 -75.69 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.434 1.494 . . . . 0.0 110.367 -169.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.4 p -77.02 -44.09 32.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.498 0.319 . . . . 0.0 110.658 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 48.9 ttp180 56.4 50.47 13.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.279 1.031 . . . . 0.0 110.291 -169.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -141.11 159.45 42.19 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.482 1.513 . . . . 0.0 108.525 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.18 137.68 32.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 169.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.22 -81.43 0.05 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.076 -1.209 . . . . 0.0 110.076 169.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.35 47.43 1.03 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.636 1.175 . . . . 0.0 111.389 -169.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -86.23 58.76 5.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.429 0.691 . . . . 0.0 110.593 -169.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.79 -62.25 1.52 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.178 0.991 . . . . 0.0 110.052 173.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -158.98 97.94 1.43 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.1 mp -69.46 145.48 52.73 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.505 0.669 . . . . 0.0 109.92 -170.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 tt -100.12 74.82 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 125.547 1.539 . . . . 0.0 107.212 -169.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.8 mp -69.35 137.23 52.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.8 t -69.55 137.91 52.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 111.131 -169.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -59.28 -48.48 81.46 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.15 0.58 . . . . 0.0 112.051 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -75.3 -54.6 6.82 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.102 1.361 . . . . 0.0 111.25 -169.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 19.1 p -120.52 2.58 10.72 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 -169.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 58.34 31.67 21.16 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.355 1.062 . . . . 0.0 113.506 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -74.16 138.67 43.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.851 0.86 . . . . 0.0 108.895 169.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -90.19 133.87 34.64 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.864 0.865 . . . . 0.0 110.521 -169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -155.47 150.8 26.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.32 1.048 . . . . 0.0 110.278 -170.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -93.09 173.42 7.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.0 mp -51.51 -57.3 9.42 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.437 1.495 . . . . 0.0 109.742 -173.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -68.56 -43.64 76.18 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.375 1.07 . . . . 0.0 110.841 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 77.8 m -62.92 -37.07 85.52 Favored 'General case' 0 C--N 1.342 0.243 0 C-N-CA 123.49 0.716 . . . . 0.0 111.289 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.77 -63.95 1.12 Allowed 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 171.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -157.34 136.13 7.88 Favored Pre-proline 0 CA--C 1.532 0.287 0 C-N-CA 122.739 0.415 . . . . 0.0 109.998 169.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -61.7 -32.16 86.55 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 124.014 3.143 . . . . 0.0 111.82 -171.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -43.92 -39.71 4.16 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 125.267 1.427 . . . . 0.0 112.957 171.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.43 91.77 6.91 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 169.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -81.1 -19.27 43.99 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.186 0.995 . . . . 0.0 110.974 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 161.31 29.48 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.879 2.071 . . . . 0.0 109.461 -171.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.6 m -75.28 148.66 83.89 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.22 0.608 . . . . 0.0 111.347 -174.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -102.71 -168.4 0.06 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 122.957 2.438 . . . . 0.0 107.118 167.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -86.32 53.42 2.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.828 -0.545 . . . . 0.0 110.169 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.58 -69.25 2.85 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.63 1.109 . . . . 0.0 112.303 169.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.27 116.33 8.74 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.328 1.451 . . . . 0.0 110.657 -169.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 36.4 t-105 -162.65 152.01 15.48 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.512 0.725 . . . . 0.0 111.015 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -84.97 134.04 34.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.065 1.346 . . . . 0.0 111.238 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 15.8 p -90.42 179.5 1.48 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.97 1.308 . . . . 0.0 110.817 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -59.52 -26.73 82.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.92 2.413 . . . . 0.0 115.564 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.6 -45.55 75.16 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 68.5 m -73.92 -48.05 33.51 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.577 0.751 . . . . 0.0 110.668 -173.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -109.21 102.56 49.57 Favored Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 126.16 1.784 . . . . 0.0 108.422 170.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_exo -58.36 84.88 0.05 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.847 3.031 . . . . 0.0 112.606 169.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -170.84 159.77 6.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.056 1.342 . . . . 0.0 109.032 -169.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.05 1.34 . . . . 0.0 109.208 169.67 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -150.54 153.91 36.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.517 0.727 . . . . 0.0 109.264 169.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.0 t -82.76 153.22 25.37 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.348 0.659 . . . . 0.0 110.065 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.42 -44.33 13.79 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.755 1.222 . . . . 0.0 110.293 172.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.1 t -68.56 -72.33 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 124.355 1.062 . . . . 0.0 110.509 -169.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.3 p -72.23 -12.41 61.15 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 118.808 -0.615 . . . . 0.0 112.24 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 60.37 64.01 1.28 Allowed 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.13 0.972 . . . . 0.0 109.1 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -157.77 146.87 19.63 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.963 -168.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -118.18 150.15 39.89 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 126.343 1.857 . . . . 0.0 107.203 168.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 144.57 -59.01 0.52 Allowed Glycine 0 C--N 1.337 0.617 0 N-CA-C 108.563 -1.815 . . . . 0.0 108.563 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -76.44 62.42 1.85 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.478 1.111 . . . . 0.0 109.827 170.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -77.64 59.83 2.05 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 109.432 171.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -85.67 -74.82 0.39 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.918 1.287 . . . . 0.0 108.62 -173.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -159.99 82.6 0.72 Allowed 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -70.69 144.51 50.99 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 tt -126.39 106.68 16.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 126.585 1.954 . . . . 0.0 107.913 -169.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.23 134.12 45.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.7 t -69.62 131.59 44.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 169.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -60.23 -53.26 59.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.588 0.755 . . . . 0.0 110.683 -176.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -61.47 -54.02 48.87 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.324 1.05 . . . . 0.0 111.83 -169.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 23.5 p -119.43 7.89 11.27 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -168.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.42 57.23 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.265 1.026 . . . . 0.0 111.53 169.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -109.35 122.84 48.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.903 1.281 . . . . 0.0 108.281 172.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.19 103.15 2.7 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.536 0.734 . . . . 0.0 109.754 173.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -106.69 151.27 25.33 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.936 1.294 . . . . 0.0 108.641 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.89 165.76 18.45 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 80.6 mt -55.62 -38.53 69.61 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.254 0.622 . . . . 0.0 109.665 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.07 -53.21 60.85 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.246 1.418 . . . . 0.0 111.187 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.2 m -69.18 -32.6 72.02 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.224 1.01 . . . . 0.0 111.225 -169.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.7 mt -54.82 -67.0 0.3 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.21 121.08 0.56 Allowed Pre-proline 0 N--CA 1.45 -0.431 0 N-CA-C 106.644 -1.613 . . . . 0.0 106.644 -176.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -59.49 -34.84 97.06 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.92 2.414 . . . . 0.0 112.033 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.63 27.79 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.587 1.155 . . . . 0.0 112.65 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.09 72.87 3.67 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 169.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -69.92 -44.66 69.19 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 168.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -73.26 165.1 25.68 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.332 1.453 . . . . 0.0 111.026 169.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.23 142.63 82.29 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.724 0.81 . . . . 0.0 110.417 176.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -81.44 120.97 3.71 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.436 2.091 . . . . 0.0 108.909 169.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -86.34 53.87 2.95 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.163 0.985 . . . . 0.0 111.083 -169.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.07 -90.53 0.08 OUTLIER Glycine 0 CA--C 1.525 0.719 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 169.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -76.8 87.57 3.41 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.15 0.98 . . . . 0.0 109.88 -169.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -74.27 78.79 1.82 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.013 0.925 . . . . 0.0 108.986 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -130.76 135.69 48.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.676 1.59 . . . . 0.0 108.523 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.5 p -92.46 165.4 19.55 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.356 0.663 . . . . 0.0 111.066 -170.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -49.44 -27.36 13.75 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.4 3.4 . . . . 0.0 116.185 170.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.45 -37.92 83.71 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 119.04 0.836 . . . . 0.0 110.022 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 51.3 m -75.24 -53.05 9.45 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.95 0.5 . . . . 0.0 110.724 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -129.93 80.65 70.8 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 125.068 1.347 . . . . 0.0 109.2 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.43 -56.61 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.791 2.327 . . . . 0.0 110.504 -176.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.94 67.46 0.54 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.373 -1.298 . . . . 0.0 108.249 -169.544 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.736 -0.098 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -69.91 90.47 0.62 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.112 0.965 . . . . 0.0 109.975 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.69 144.23 52.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.4 1.48 . . . . 0.0 110.847 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -56.44 -51.25 69.12 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.363 1.065 . . . . 0.0 111.394 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.9 t -65.36 -70.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 C-N-CA 123.942 0.897 . . . . 0.0 109.448 -169.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.56 -29.66 59.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.659 -170.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.9 mtm180 52.8 57.77 6.03 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.202 1.001 . . . . 0.0 109.872 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -138.96 158.43 44.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.263 1.425 . . . . 0.0 108.623 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.2 tttm -134.35 94.47 3.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 107.065 -1.458 . . . . 0.0 107.065 169.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.02 -48.25 0.02 OUTLIER Glycine 0 CA--C 1.522 0.516 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 41.96 0.57 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.048 1.339 . . . . 0.0 111.701 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -82.38 60.14 4.92 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 109.837 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -66.8 -59.35 3.62 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.997 0.919 . . . . 0.0 109.647 169.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -167.63 106.59 0.55 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.06 1.344 . . . . 0.0 107.759 -177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -69.85 109.27 4.36 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 169.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -94.71 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 125.337 1.455 . . . . 0.0 108.339 171.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.18 149.66 48.35 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 39.0 t -79.25 124.66 28.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 169.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -60.85 -51.02 71.08 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.244 0.617 . . . . 0.0 110.429 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.49 -58.93 5.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.121 1.369 . . . . 0.0 111.227 -169.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.5 p -95.05 -18.12 21.29 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.86 44.25 2.11 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.064 1.346 . . . . 0.0 111.613 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -107.47 157.89 17.64 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.431 1.493 . . . . 0.0 109.919 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -99.97 135.95 40.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.499 1.52 . . . . 0.0 111.212 -169.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -152.23 124.76 8.32 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.585 1.554 . . . . 0.0 108.029 -170.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -74.29 165.79 24.57 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 54.7 mt -50.14 -50.23 49.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.373 0.669 . . . . 0.0 110.616 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -52.62 -41.47 63.73 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.421 1.488 . . . . 0.0 111.976 177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.97 -24.53 60.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.736 0.815 . . . . 0.0 111.273 -173.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.37 -55.8 8.22 Favored 'General case' 0 C--N 1.341 0.232 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.0 ptt85 -160.36 140.28 8.36 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 124.443 1.097 . . . . 0.0 108.684 169.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -58.88 -38.07 90.33 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.5 2.8 . . . . 0.0 111.742 -169.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.34 11.47 8.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.815 0.846 . . . . 0.0 112.849 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.5 tp -77.66 89.16 3.94 Favored 'General case' 0 C--N 1.343 0.287 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -90.06 -21.45 22.31 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.495 1.118 . . . . 0.0 110.607 169.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.31 154.89 41.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.893 1.277 . . . . 0.0 109.109 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.6 t -124.57 93.79 45.72 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -173.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -98.15 76.82 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.027 0 C-N-CA 122.744 2.296 . . . . 0.0 108.599 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -75.87 65.1 1.91 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.549 0.69 . . . . 0.0 109.854 175.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.03 -49.88 0.04 OUTLIER Glycine 0 CA--C 1.528 0.859 0 N-CA-C 109.161 -1.576 . . . . 0.0 109.161 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.29 62.51 3.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.267 1.027 . . . . 0.0 109.891 175.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m0 -76.25 83.63 3.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.484 1.114 . . . . 0.0 109.373 -177.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -136.16 169.03 18.29 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 125.632 1.573 . . . . 0.0 109.629 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 29.2 p -137.71 152.73 73.16 Favored Pre-proline 0 CA--C 1.531 0.214 0 C-N-CA 124.746 1.218 . . . . 0.0 108.477 169.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.01 -3.17 10.97 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.366 2.711 . . . . 0.0 113.573 -172.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.76 -47.76 24.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.349 0.66 . . . . 0.0 109.32 169.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.81 -58.43 3.29 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.129 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -73.92 133.21 79.2 Favored Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 124.311 1.044 . . . . 0.0 109.169 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -58.92 127.78 25.58 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.412 2.075 . . . . 0.0 112.109 169.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.14 137.84 12.07 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.259 1.024 . . . . 0.0 108.914 -170.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.25 1.111 0 CA-C-O 117.394 -1.289 . . . . 0.0 108.391 -178.985 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.409 0.147 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.51 80.95 3.2 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.5 1.12 . . . . 0.0 110.667 -169.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.6 t -69.21 158.15 35.51 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.07 2.148 . . . . 0.0 109.207 169.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -73.54 -42.99 60.97 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 121.064 -1.023 . . . . 0.0 110.762 175.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -61.62 -68.16 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.823 1.249 . . . . 0.0 110.507 -176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 10.3 p -98.06 -46.23 5.96 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.986 0.914 . . . . 0.0 110.914 -170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 72.89 -0.56 3.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.732 1.613 . . . . 0.0 115.257 169.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -69.93 156.11 39.59 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 118.683 0.674 . . . . 0.0 111.091 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -94.69 159.75 14.93 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 168.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.87 -59.11 0.68 Allowed Glycine 0 C--N 1.337 0.614 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -79.83 63.84 4.5 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.01 0.924 . . . . 0.0 108.826 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -83.55 57.04 3.85 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.327 1.051 . . . . 0.0 108.726 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -85.58 -80.27 0.22 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.559 1.143 . . . . 0.0 109.425 -169.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -169.17 81.05 0.13 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 125.2 1.4 . . . . 0.0 108.225 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -70.13 164.89 23.18 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.302 0.641 . . . . 0.0 110.284 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 tt -142.83 125.41 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 125.265 1.426 . . . . 0.0 108.052 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -103.7 137.07 42.25 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.532 1.133 . . . . 0.0 108.823 -173.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.83 119.67 14.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 169.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.49 -48.19 77.68 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.617 0.767 . . . . 0.0 111.009 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.87 -61.95 2.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.739 1.216 . . . . 0.0 111.387 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.1 p -120.33 18.85 12.18 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -168.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 54.48 70.21 0.64 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 124.664 1.186 . . . . 0.0 111.76 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.83 102.31 8.49 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 124.566 1.146 . . . . 0.0 108.033 175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.44 128.73 37.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.546 0.738 . . . . 0.0 109.799 172.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -144.02 146.5 32.91 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.96 1.304 . . . . 0.0 108.673 -169.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -87.72 158.35 18.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 167.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.2 mt -52.45 -45.2 65.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.142 0.977 . . . . 0.0 110.516 169.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -48.91 74.14 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.104 0.962 . . . . 0.0 110.437 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.1 m -60.33 -34.19 73.46 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 124.11 0.964 . . . . 0.0 111.323 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 mt -61.77 -74.42 0.09 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 169.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -151.41 153.76 32.74 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 124.866 1.266 . . . . 0.0 108.948 -177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -64.18 -38.39 36.27 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.678 2.252 . . . . 0.0 110.763 169.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.39 -41.76 20.57 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.028 1.331 . . . . 0.0 112.475 173.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.29 83.96 3.74 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 169.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -78.42 -55.16 5.44 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.875 0.87 . . . . 0.0 108.995 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -106.97 170.26 8.05 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.922 1.689 . . . . 0.0 110.363 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 8.4 p -67.62 142.78 96.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.053 0.941 . . . . 0.0 111.563 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -78.71 110.21 2.76 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.277 1.985 . . . . 0.0 108.326 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -77.32 67.45 3.27 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.708 0.803 . . . . 0.0 109.693 176.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.78 -176.36 47.21 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.177 -1.169 . . . . 0.0 110.177 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -64.07 141.22 58.85 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.57 0.748 . . . . 0.0 110.337 178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -160.0 152.15 20.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.737 0.815 . . . . 0.0 109.756 -170.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -140.23 165.98 25.91 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.894 1.278 . . . . 0.0 109.583 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.0 p -69.62 154.08 95.11 Favored Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 123.519 0.728 . . . . 0.0 109.957 173.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.83 -5.41 16.81 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.876 2.384 . . . . 0.0 113.487 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.42 -40.48 81.2 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.451 0.569 . . . . 0.0 109.691 169.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.73 -48.8 52.64 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 122.905 0.482 . . . . 0.0 110.634 173.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -119.85 88.75 40.71 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.266 1.026 . . . . 0.0 111.385 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_exo -63.56 83.41 0.13 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.984 2.456 . . . . 0.0 112.06 169.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.71 67.42 2.8 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.56 1.144 . . . . 0.0 109.86 171.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 36.0 p . . . . . 0 C--O 1.251 1.136 0 C-N-CA 125.178 1.391 . . . . 0.0 108.367 -169.874 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 119.698 -0.192 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -154.38 160.06 41.47 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.36 0.664 . . . . 0.0 109.579 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -142.56 153.63 43.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.613 1.165 . . . . 0.0 110.317 -169.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -67.52 -51.38 51.61 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.25 1.02 . . . . 0.0 111.524 173.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.7 t -72.7 -73.35 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.106 0 C-N-CA 124.069 0.948 . . . . 0.0 110.089 -169.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.4 p -73.58 -35.8 65.48 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 119.15 -0.452 . . . . 0.0 111.112 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 56.09 59.56 3.66 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.391 1.076 . . . . 0.0 109.794 -175.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -129.6 174.64 9.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.258 1.423 . . . . 0.0 109.418 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -142.31 85.84 1.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 169.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -161.12 -67.99 0.02 OUTLIER Glycine 0 C--N 1.337 0.587 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -170.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.33 50.82 1.84 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.965 0.906 . . . . 0.0 110.895 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -86.07 61.05 6.6 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.845 0.858 . . . . 0.0 109.658 -178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -72.93 -69.35 0.42 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.709 1.204 . . . . 0.0 109.694 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -147.97 91.93 1.99 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.603 1.561 . . . . 0.0 106.855 -170.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -70.14 92.47 0.76 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.013 0.525 . . . . 0.0 109.676 173.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 tt -76.23 105.72 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 124.722 1.209 . . . . 0.0 108.848 169.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.7 mp -72.27 148.04 45.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 169.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -70.14 125.74 27.65 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -60.03 -43.65 95.15 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.179 0.592 . . . . 0.0 111.552 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.18 -59.61 4.22 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.561 1.144 . . . . 0.0 110.672 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.7 p -106.14 -5.29 19.46 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -169.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.44 57.94 2.68 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.412 1.085 . . . . 0.0 110.649 172.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -121.81 144.75 48.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.402 1.481 . . . . 0.0 108.852 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.69 121.49 26.92 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.815 1.246 . . . . 0.0 111.293 -169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -132.65 164.87 25.75 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.361 1.465 . . . . 0.0 109.495 170.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -105.17 163.2 12.75 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 168.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.9 mt -58.5 -41.27 85.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 122.498 0.319 . . . . 0.0 110.499 169.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -47.21 -51.38 18.74 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.313 1.045 . . . . 0.0 111.88 170.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.22 -36.26 69.1 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.596 0.758 . . . . 0.0 110.677 -170.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 89.3 mt -82.53 -72.73 0.43 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 123.215 0.606 . . . . 0.0 111.806 177.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -137.91 84.88 20.61 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.723 1.609 . . . . 0.0 109.521 -168.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -65.32 -23.96 58.4 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.187 2.591 . . . . 0.0 112.382 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.53 -38.39 63.73 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.395 1.078 . . . . 0.0 112.737 170.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.65 129.04 34.29 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 169.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -112.17 -21.66 11.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.146 1.378 . . . . 0.0 110.772 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 0.7 OUTLIER -99.56 159.76 14.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.744 2.018 . . . . 0.0 108.628 169.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.23 139.08 94.77 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.69 167.58 25.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.453 2.102 . . . . 0.0 110.413 169.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -111.22 64.57 0.61 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.861 0.864 . . . . 0.0 109.559 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.84 -66.68 0.22 Allowed Glycine 0 C--N 1.339 0.699 0 N-CA-C 111.704 -0.558 . . . . 0.0 111.704 169.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -83.33 114.29 21.31 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.159 0.584 . . . . 0.0 110.168 -169.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 7.1 m0 -138.67 59.39 1.63 Allowed 'General case' 0 C--N 1.341 0.204 0 C-N-CA 124.205 1.002 . . . . 0.0 110.427 -169.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -132.65 155.4 48.84 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 121.1 0.476 . . . . 0.0 112.023 -172.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 p -110.03 155.09 42.29 Favored Pre-proline 0 CA--C 1.532 0.272 0 C-N-CA 125.732 1.613 . . . . 0.0 109.389 -173.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -38.37 -44.42 2.06 Favored 'Trans proline' 0 C--N 1.348 0.544 1 C-N-CA 125.538 4.159 . . . . 0.0 116.858 -168.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -39.94 76.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.524 0.73 . . . . 0.0 110.021 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.53 -48.55 64.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.552 0.741 . . . . 0.0 110.413 169.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -165.01 133.36 2.57 Favored Pre-proline 0 N--CA 1.453 -0.32 0 C-N-CA 124.687 1.195 . . . . 0.0 109.015 -173.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -78.48 73.1 6.02 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.669 2.246 . . . . 0.0 108.317 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.06 159.16 33.4 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.02 0.928 . . . . 0.0 111.905 -169.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.352 1.461 . . . . 0.0 109.35 -178.968 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 119.747 -0.168 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.5 mtm180 -142.74 176.84 8.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.564 1.146 . . . . 0.0 109.247 169.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.7 t -133.16 149.64 52.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.675 1.59 . . . . 0.0 109.082 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -56.17 -50.07 72.21 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 125.002 1.321 . . . . 0.0 110.999 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 86.8 t -64.81 -54.2 32.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 124.896 1.278 . . . . 0.0 110.034 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 31.0 m -72.94 -42.41 63.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.532 0.333 . . . . 0.0 111.372 -170.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 58.07 31.6 20.9 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.864 1.666 . . . . 0.0 110.687 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -155.5 166.57 33.14 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.214 2.206 . . . . 0.0 107.376 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -76.83 85.3 3.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 169.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.25 -133.34 0.75 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 110.679 -0.968 . . . . 0.0 110.679 178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -81.51 71.38 8.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.34 69.32 3.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.508 1.123 . . . . 0.0 109.766 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -99.7 -56.25 2.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.135 2.174 . . . . 0.0 108.277 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -143.67 84.86 1.81 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.841 1.657 . . . . 0.0 107.591 -169.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.36 164.11 27.13 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.514 0.673 . . . . 0.0 110.938 172.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.6 tt -157.62 109.48 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 C-N-CA 125.895 1.678 . . . . 0.0 106.779 -172.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mp -92.67 140.27 29.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.599 0.76 . . . . 0.0 109.301 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.99 106.33 3.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 169.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -65.9 -25.55 67.21 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -171.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -67.41 -70.98 0.22 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.969 0.908 . . . . 0.0 110.798 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 p -106.32 9.6 31.88 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.746 0.818 . . . . 0.0 112.854 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 58.82 74.6 0.43 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.219 1.408 . . . . 0.0 111.801 169.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -131.98 123.48 27.44 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.367 1.467 . . . . 0.0 108.168 174.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.99 138.99 42.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.421 0.688 . . . . 0.0 110.364 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -141.48 166.74 23.93 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.572 1.149 . . . . 0.0 109.79 172.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -99.66 149.92 22.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 168.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.1 mt -54.99 -41.63 71.46 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.646 0.378 . . . . 0.0 110.771 169.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -49.67 -53.4 24.66 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.755 1.222 . . . . 0.0 111.803 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 57.8 m -68.85 -36.59 78.35 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.388 0.675 . . . . 0.0 110.619 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 74.0 mt -81.79 -78.91 0.18 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.538 0.735 . . . . 0.0 111.885 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -136.38 83.94 30.36 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.639 1.575 . . . . 0.0 108.418 -169.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -62.39 -28.85 78.69 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 123.208 2.606 . . . . 0.0 112.327 -169.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.86 -36.07 62.22 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.751 1.221 . . . . 0.0 113.051 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.6 mt -75.63 88.49 2.74 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 169.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -70.85 -35.47 72.43 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.237 0.615 . . . . 0.0 111.294 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -101.3 158.29 16.15 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.006 1.323 . . . . 0.0 109.988 175.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.5 t -66.81 123.08 85.08 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 124.033 0.933 . . . . 0.0 108.706 174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -70.53 153.01 65.71 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.213 2.609 . . . . 0.0 111.0 -170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -86.64 53.53 2.85 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.98 0.912 . . . . 0.0 110.136 -172.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.19 -172.96 45.93 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.21 162.43 24.95 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.069 1.347 . . . . 0.0 110.851 -169.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -153.09 147.12 25.46 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 120.927 0.394 . . . . 0.0 111.106 171.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 152.08 49.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.144 0.978 . . . . 0.0 110.093 169.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.0 p -73.72 163.28 69.5 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.224 1.41 . . . . 0.0 111.37 -169.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -48.36 -26.74 8.92 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.709 3.606 . . . . 0.0 116.212 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.55 75.91 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.483 0.583 . . . . 0.0 110.554 175.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.12 -43.12 44.65 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.455 0.702 . . . . 0.0 111.48 174.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -113.02 78.14 2.92 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 125.208 1.403 . . . . 0.0 111.209 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -84.37 178.09 5.36 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.753 2.302 . . . . 0.0 109.283 169.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.13 94.45 1.53 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 116.848 -1.548 . . . . 0.0 110.174 175.395 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 110.6 -0.148 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -118.54 132.46 56.21 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.084 0.954 . . . . 0.0 110.142 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -69.78 143.4 52.98 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.963 1.705 . . . . 0.0 110.281 171.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -69.94 -41.65 74.28 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.94 0.896 . . . . 0.0 111.321 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.64 -67.44 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.127 0.971 . . . . 0.0 110.224 -172.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.1 p -72.13 -43.4 64.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.195 -177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 42.46 43.19 3.02 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.764 1.626 . . . . 0.0 113.54 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -141.2 145.71 35.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.888 1.675 . . . . 0.0 107.4 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.37 133.56 47.96 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 -177.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -173.61 -102.74 0.16 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -82.98 67.3 9.01 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.79 0.836 . . . . 0.0 109.616 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.89 61.64 3.87 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.745 0.818 . . . . 0.0 109.361 176.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -92.87 -71.41 0.65 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.54 1.536 . . . . 0.0 109.417 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -143.15 88.38 2.03 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.217 1.407 . . . . 0.0 107.986 -174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.63 119.14 13.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.859 0.863 . . . . 0.0 108.709 175.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.7 tt -100.28 121.79 51.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.081 1.352 . . . . 0.0 108.62 178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -88.04 141.12 28.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.964 0.906 . . . . 0.0 109.816 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -74.91 131.45 40.71 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -70.59 -38.89 74.09 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 -169.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -67.71 -66.18 0.6 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.409 1.084 . . . . 0.0 110.822 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.3 p -93.59 -10.87 33.21 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -169.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 60.63 60.23 1.99 Allowed 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.893 0.877 . . . . 0.0 110.037 174.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -128.4 141.33 51.45 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.985 1.714 . . . . 0.0 108.257 175.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.48 139.53 30.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.385 1.074 . . . . 0.0 111.378 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -143.51 173.08 11.95 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.444 1.898 . . . . 0.0 109.18 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -123.58 152.42 41.88 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 168.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' H ' HD22 ' A' ' 27' ' ' LEU . 3.1 mm? -57.37 -43.08 83.26 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -41.52 -57.09 2.34 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.088 1.755 . . . . 0.0 112.123 169.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.0 m -76.94 -35.35 57.34 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.748 1.219 . . . . 0.0 111.042 -169.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.4 mt -63.58 -70.42 0.22 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.63 0.772 . . . . 0.0 110.224 173.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -150.77 115.9 3.27 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 124.736 1.215 . . . . 0.0 108.489 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -64.61 -19.16 64.66 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.772 2.981 . . . . 0.0 113.31 -169.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.91 -33.19 64.44 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.151 0.98 . . . . 0.0 112.781 169.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.94 158.35 19.3 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.957 0.903 . . . . 0.0 110.221 174.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -147.69 -50.23 0.18 Allowed 'General case' 0 C--N 1.339 0.124 0 C-N-CA 125.015 1.326 . . . . 0.0 109.793 -170.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -93.33 150.72 20.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.806 1.242 . . . . 0.0 110.388 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.6 t -67.68 124.67 89.89 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 124.31 1.044 . . . . 0.0 108.566 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.1 155.06 62.01 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.003 2.468 . . . . 0.0 110.723 -175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.62 58.28 4.51 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.998 0.919 . . . . 0.0 110.132 -176.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -172.48 165.43 37.95 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 169.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.19 120.71 9.72 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.778 1.231 . . . . 0.0 109.778 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 71.8 t-105 -85.24 143.15 28.92 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.619 0.368 . . . . 0.0 110.452 -170.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -122.92 129.68 51.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.512 1.125 . . . . 0.0 108.045 169.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.4 p -81.64 163.54 53.53 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 123.197 0.599 . . . . 0.0 110.464 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.14 -9.84 7.08 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 124.355 3.37 . . . . 0.0 116.779 171.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.6 -48.78 24.58 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 119.38 0.991 . . . . 0.0 109.685 169.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 70.0 m -78.54 -58.35 3.29 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.05 0.54 . . . . 0.0 110.379 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 -74.84 125.65 89.22 Favored Pre-proline 0 N--CA 1.453 -0.304 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 170.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -79.88 69.5 7.91 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.349 2.032 . . . . 0.0 110.332 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -163.61 149.52 11.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 124.931 1.292 . . . . 0.0 108.948 169.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.252 1.195 0 CA-C-O 117.627 -1.178 . . . . 0.0 110.454 178.773 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.223 0.059 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -75.81 91.28 2.95 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.708 0.803 . . . . 0.0 109.802 -169.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -68.53 135.67 51.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.474 1.11 . . . . 0.0 109.224 172.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -69.18 -27.07 65.19 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.883 0.473 . . . . 0.0 112.037 -171.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.7 t -70.32 -75.22 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 124.182 0.993 . . . . 0.0 110.423 174.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.6 p -78.58 -23.77 45.87 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 51.72 46.19 26.95 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.391 1.477 . . . . 0.0 110.479 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -164.47 159.48 19.46 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -168.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -69.44 111.12 5.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 169.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -104.4 -135.89 8.62 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 108.468 -1.853 . . . . 0.0 108.468 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -76.22 75.53 3.04 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -79.38 66.8 4.94 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 123.556 0.743 . . . . 0.0 109.523 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -120.39 -55.29 2.05 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 126.558 1.943 . . . . 0.0 108.481 -173.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -128.12 70.3 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.383 1.473 . . . . 0.0 109.115 -174.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.82 158.26 35.81 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.373 0.606 . . . . 0.0 109.73 169.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.1 tt -152.54 130.77 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 125.196 1.398 . . . . 0.0 107.447 -169.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -87.0 141.08 28.93 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.4 t -70.04 131.29 44.12 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 169.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -63.54 -49.82 71.98 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 122.864 0.466 . . . . 0.0 110.426 -172.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -67.64 -50.52 57.59 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.481 1.113 . . . . 0.0 112.242 -169.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -117.42 4.12 12.5 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -169.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 54.41 61.4 3.03 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.285 1.034 . . . . 0.0 111.672 169.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -117.35 128.51 55.11 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.892 1.277 . . . . 0.0 108.477 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.88 129.72 40.29 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.348 0.659 . . . . 0.0 110.148 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -144.9 166.4 25.38 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.294 1.437 . . . . 0.0 108.978 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -103.52 160.03 15.08 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 168.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.8 mt -49.25 -50.61 37.92 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.348 1.059 . . . . 0.0 110.609 169.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -68.26 -44.86 74.66 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.7 1.2 . . . . 0.0 110.459 -175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.1 m -67.94 -28.2 67.26 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.745 0.818 . . . . 0.0 112.017 -177.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 mt -59.72 -68.5 0.28 Allowed 'General case' 0 C--N 1.343 0.313 0 CA-C-N 118.648 0.658 . . . . 0.0 109.338 169.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 85.5 mtt-85 -146.09 137.23 12.7 Favored Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 123.545 0.738 . . . . 0.0 109.033 -169.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -65.03 -40.91 18.61 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.236 2.624 . . . . 0.0 111.034 -170.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.01 -26.3 68.22 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.194 0.998 . . . . 0.0 112.534 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.7 tp -82.45 77.64 9.2 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -175.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -71.92 -42.29 66.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.513 0.725 . . . . 0.0 110.853 170.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -96.65 168.56 10.44 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.714 1.206 . . . . 0.0 111.158 -169.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.08 134.84 94.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.52 1.128 . . . . 0.0 109.659 177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -94.03 156.17 2.2 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.098 2.532 . . . . 0.0 110.763 169.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -134.1 75.46 1.59 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.53 1.132 . . . . 0.0 108.214 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.65 -145.41 4.85 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -174.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -73.15 96.45 2.23 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.858 0.863 . . . . 0.0 109.667 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -81.4 68.8 7.86 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.458 0.703 . . . . 0.0 109.118 178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -97.47 133.99 41.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.042 0.537 . . . . 0.0 109.793 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -81.08 162.37 59.66 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.979 1.311 . . . . 0.0 109.823 -178.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -40.42 -32.73 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.454 1 C-N-CA 125.921 4.414 . . . . 0.0 116.834 171.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.11 -53.5 12.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -174.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 p -79.61 -56.46 4.28 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.189 0.305 . . . . 0.0 111.325 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -92.65 118.04 67.82 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -43.21 146.42 1.06 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 124.811 3.674 . . . . 0.0 115.444 -169.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -51.92 110.28 0.46 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.909 1.283 . . . . 0.0 111.015 175.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.373 -1.775 . . . . 0.0 106.857 -171.554 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -73.85 109.41 7.34 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -71.07 145.32 49.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.765 0.826 . . . . 0.0 109.806 169.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.29 -54.47 17.29 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.243 1.017 . . . . 0.0 109.709 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.3 t -52.75 -67.92 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 C-N-CA 125.502 1.521 . . . . 0.0 111.146 -169.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.15 -7.59 57.23 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 118.72 -0.657 . . . . 0.0 112.552 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 56.48 51.42 11.36 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.265 1.026 . . . . 0.0 109.19 174.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -159.93 145.06 15.18 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.393 0.677 . . . . 0.0 109.662 -168.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 ptmm? -107.06 59.53 0.62 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.283 1.033 . . . . 0.0 109.837 169.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.33 -68.65 1.24 Allowed Glycine 0 C--N 1.337 0.588 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -85.71 68.3 10.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 -170.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -78.85 65.67 4.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.066 0.946 . . . . 0.0 109.736 -174.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -96.87 -69.87 0.74 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.568 1.547 . . . . 0.0 108.836 -169.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -165.63 77.43 0.27 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.636 1.174 . . . . 0.0 109.206 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.3 mp -69.14 147.61 51.14 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.877 -0.514 . . . . 0.0 110.546 -169.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.2 tt -116.37 70.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.066 1.747 . . . . 0.0 107.909 -169.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.93 144.07 52.51 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.821 0.848 . . . . 0.0 109.055 -173.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.3 t -69.92 113.25 6.97 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -52.51 -41.27 63.3 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.663 1.185 . . . . 0.0 112.433 177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.06 -66.07 0.6 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.749 0.82 . . . . 0.0 110.836 -171.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.0 p -109.01 8.9 26.45 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.055 0.942 . . . . 0.0 113.157 -169.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.75 51.51 10.83 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.508 1.123 . . . . 0.0 111.182 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -105.85 122.42 46.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.899 1.279 . . . . 0.0 108.473 172.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.26 134.31 36.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 110.162 -170.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -147.37 140.49 25.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.208 1.003 . . . . 0.0 110.18 -169.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -90.56 160.58 15.87 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 167.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.47 -43.2 93.3 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -57.19 -39.39 75.27 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.138 1.375 . . . . 0.0 111.552 178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 73.2 m -72.71 -29.78 63.65 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.721 0.808 . . . . 0.0 111.493 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.92 -53.32 52.28 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 168.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -168.86 143.45 2.58 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 109.107 169.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -60.77 -39.22 64.68 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.151 2.568 . . . . 0.0 111.584 -176.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.37 -32.06 47.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.836 1.254 . . . . 0.0 113.132 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.7 tp -77.56 95.08 4.45 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 170.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -92.95 -36.61 12.68 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.504 1.122 . . . . 0.0 111.301 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -114.85 161.52 18.12 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 125.266 1.427 . . . . 0.0 109.576 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 27.0 m -61.61 155.25 61.12 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 124.114 0.966 . . . . 0.0 112.02 -169.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -83.88 -112.15 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.737 2.958 . . . . 0.0 108.599 173.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -89.47 39.56 0.95 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.882 0.873 . . . . 0.0 110.555 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.54 -87.59 0.34 Allowed Glycine 0 CA--C 1.528 0.861 0 C-N-CA 124.373 0.987 . . . . 0.0 111.109 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -67.68 134.12 50.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.239 1.016 . . . . 0.0 109.441 173.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -164.46 154.51 14.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.307 0.643 . . . . 0.0 109.598 -169.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -121.46 160.14 24.78 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.412 1.085 . . . . 0.0 110.389 -173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -70.75 158.12 88.68 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.402 1.081 . . . . 0.0 110.359 -172.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -44.87 -37.59 12.19 Favored 'Trans proline' 0 C--N 1.35 0.615 1 C-N-CA 125.461 4.107 . . . . 0.0 116.0 -169.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.0 71.57 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.48 0.712 . . . . 0.0 110.128 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.9 m -72.92 -55.53 6.47 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.482 1.113 . . . . 0.0 110.125 178.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -132.23 109.91 13.9 Favored Pre-proline 0 N--CA 1.453 -0.288 0 C-N-CA 126.336 1.854 . . . . 0.0 107.205 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -49.55 131.29 27.84 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.78 2.987 . . . . 0.0 112.743 170.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.65 111.9 2.28 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 123.718 0.807 . . . . 0.0 109.726 174.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 p . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.105 -1.426 . . . . 0.0 109.188 169.845 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -69.8 116.77 10.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.027 0.531 . . . . 0.0 110.385 171.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.4 t -80.89 145.48 31.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.713 1.205 . . . . 0.0 109.258 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -56.43 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.723 1.209 . . . . 0.0 110.817 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.5 t -58.41 -53.77 41.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 124.935 1.294 . . . . 0.0 110.063 -178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.2 m -68.25 -25.3 65.12 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.114 0.566 . . . . 0.0 112.222 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.253 10.1 ptp180 39.1 41.5 0.59 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.364 2.265 . . . . 0.0 113.004 -169.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -168.93 141.58 2.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 126.505 1.922 . . . . 0.0 106.566 -170.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -71.88 130.29 40.67 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 169.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -144.21 -101.24 0.34 Allowed Glycine 0 C--N 1.339 0.704 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -76.95 84.27 3.49 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.552 0.741 . . . . 0.0 109.152 -176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -78.44 56.1 1.71 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.833 0.853 . . . . 0.0 110.266 175.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -96.35 -67.21 0.86 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.898 1.279 . . . . 0.0 109.307 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -164.92 76.68 0.29 Allowed 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -168.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.18 156.75 39.21 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.442 0.639 . . . . 0.0 110.586 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 6.4 tt -121.61 87.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 127.163 2.185 . . . . 0.0 106.849 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.26 131.68 44.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 172.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 25.1 t -69.79 137.2 51.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.67 0.271 . . . . 0.0 110.595 -170.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.46 -49.97 71.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.824 0.849 . . . . 0.0 109.921 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -66.91 -58.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.385 1.074 . . . . 0.0 111.34 -171.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.46 9.86 11.02 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -168.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 t30 52.33 51.91 15.3 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.249 1.02 . . . . 0.0 112.591 169.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -102.09 130.22 48.63 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.04 1.336 . . . . 0.0 108.39 169.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.01 124.36 25.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.817 0.847 . . . . 0.0 110.038 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -135.68 158.6 43.98 Favored 'General case' 0 N--CA 1.457 -0.086 0 C-N-CA 124.37 1.068 . . . . 0.0 109.702 172.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -95.45 149.67 21.14 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 33.0 mt -53.53 -45.45 69.79 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.483 0.713 . . . . 0.0 109.556 169.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -49.53 -53.61 22.58 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.703 1.601 . . . . 0.0 111.645 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 92.2 m -69.96 -34.11 72.98 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.08 0.952 . . . . 0.0 111.089 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 96.0 mt -60.39 -60.52 3.68 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 169.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -163.84 126.08 1.6 Allowed Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -60.25 -32.0 93.74 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.935 2.423 . . . . 0.0 112.151 -174.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.04 -39.51 9.28 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.967 1.307 . . . . 0.0 112.843 169.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.9 96.29 3.11 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 169.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -91.22 -50.55 5.77 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.156 0.982 . . . . 0.0 108.539 169.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -100.75 170.46 8.32 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.563 1.545 . . . . 0.0 110.054 169.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.4 152.09 96.52 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.732 0.813 . . . . 0.0 111.286 -173.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -89.0 141.64 4.35 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.026 2.484 . . . . 0.0 109.782 169.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -82.18 62.39 5.88 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.906 1.282 . . . . 0.0 110.321 175.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -166.98 -163.22 20.43 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -73.75 114.59 12.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.942 0.897 . . . . 0.0 109.339 -170.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 48.2 m0 -77.94 77.39 4.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.771 0.829 . . . . 0.0 109.413 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mm100 -83.94 -179.75 7.34 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.659 0.784 . . . . 0.0 110.471 170.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 27.2 p -143.93 166.6 18.5 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 123.844 0.858 . . . . 0.0 110.309 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -46.43 -26.7 4.31 Favored 'Trans proline' 0 N--CA 1.459 -0.516 1 C-N-CA 125.696 4.264 . . . . 0.0 116.705 172.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.77 79.91 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.763 0.71 . . . . 0.0 110.564 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.7 m -76.42 -59.77 2.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.149 0.579 . . . . 0.0 109.896 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -76.7 147.45 78.09 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.171 0.988 . . . . 0.0 110.005 -169.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.31 60.14 7.25 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.167 2.578 . . . . 0.0 109.739 172.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -172.36 -178.71 2.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.048 1.339 . . . . 0.0 109.101 -169.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 48.2 m . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.44 -1.267 . . . . 0.0 108.469 169.951 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.777 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.62 116.01 15.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.781 0.433 . . . . 0.0 110.702 -169.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 32.2 t -69.63 139.94 53.64 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.094 0.558 . . . . 0.0 110.223 169.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -77.41 -36.18 53.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.153 1.381 . . . . 0.0 111.893 -178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 67.1 t -61.08 -69.32 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 123.979 0.912 . . . . 0.0 109.885 -176.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 p -78.72 -40.78 32.64 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.978 0.511 . . . . 0.0 111.256 -170.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.7 mtm105 54.58 40.36 31.8 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.553 1.141 . . . . 0.0 111.184 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -117.53 125.24 50.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.273 1.429 . . . . 0.0 108.019 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -69.87 114.09 7.72 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.62 -87.56 0.07 OUTLIER Glycine 0 CA--C 1.525 0.674 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 169.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.75 40.03 1.07 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.73 1.212 . . . . 0.0 110.828 -169.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -86.98 54.92 3.35 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.995 0.918 . . . . 0.0 110.84 -169.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -93.21 -76.21 0.48 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.319 1.047 . . . . 0.0 110.262 -169.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -126.54 77.53 1.71 Allowed 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.105 1.362 . . . . 0.0 107.932 -169.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.86 143.64 52.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.635 1.174 . . . . 0.0 109.793 -169.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.4 tt -81.09 77.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 169.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.21 116.65 9.89 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.267 1.427 . . . . 0.0 108.582 170.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.2 t -69.82 132.38 45.95 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.733 0.413 . . . . 0.0 111.318 -169.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -55.35 -52.26 64.08 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.772 1.229 . . . . 0.0 110.858 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -66.08 -59.1 4.12 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.554 1.142 . . . . 0.0 111.606 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.5 p -120.36 8.05 10.77 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -168.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 52.15 45.34 28.55 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.652 1.181 . . . . 0.0 112.99 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -91.03 124.69 35.46 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.219 1.008 . . . . 0.0 108.367 169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -74.32 114.09 12.29 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.614 0.766 . . . . 0.0 109.556 174.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -128.48 146.55 50.78 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.045 1.338 . . . . 0.0 109.456 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -84.32 163.68 19.45 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 167.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 76.1 mt -56.97 -51.58 68.64 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 169.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -53.35 -48.39 68.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.243 1.017 . . . . 0.0 111.505 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 75.4 m -66.83 -31.35 71.91 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.064 0.946 . . . . 0.0 111.872 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tt -64.25 -70.08 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 169.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -154.88 142.55 14.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 125.741 1.616 . . . . 0.0 108.02 169.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.62 53.37 4.7 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 123.105 2.536 . . . . 0.0 110.22 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -120.32 -48.42 2.31 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 126.768 2.027 . . . . 0.0 108.342 169.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.64 126.99 30.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 169.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -121.35 -36.29 3.11 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.073 1.349 . . . . 0.0 110.037 174.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -87.53 148.8 24.74 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.094 0.957 . . . . 0.0 109.065 169.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 93.3 t -73.96 136.82 76.33 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -77.9 88.11 1.46 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.319 2.013 . . . . 0.0 108.441 169.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -72.5 69.48 0.85 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.516 0.727 . . . . 0.0 110.226 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.24 -57.92 0.02 OUTLIER Glycine 0 CA--C 1.526 0.738 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.47 151.94 47.86 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.272 1.429 . . . . 0.0 109.004 174.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 28.7 m-90 -136.56 105.7 5.99 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 -169.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -125.6 169.88 12.04 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.568 1.147 . . . . 0.0 109.126 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.4 p -131.99 170.9 10.13 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 125.486 1.514 . . . . 0.0 108.889 -178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -66.22 -20.72 55.8 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.892 3.061 . . . . 0.0 114.046 -172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.61 87.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 65.0 m -76.11 -30.07 58.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.66 0.784 . . . . 0.0 111.329 175.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -116.53 79.79 9.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 126.121 1.768 . . . . 0.0 110.282 -177.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.39 72.8 5.82 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 123.238 2.626 . . . . 0.0 110.219 173.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.99 151.76 44.3 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.073 0.949 . . . . 0.0 111.01 176.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.053 -1.451 . . . . 0.0 108.495 171.615 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 120.446 0.165 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.2 ptm85 -70.98 -179.8 2.43 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.344 0.657 . . . . 0.0 111.7 169.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.2 t -129.78 163.44 26.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.22 1.408 . . . . 0.0 110.506 -169.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -81.72 -40.46 22.73 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.021 0.928 . . . . 0.0 111.448 171.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.08 -74.82 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.166 0.987 . . . . 0.0 109.876 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 p -81.27 -22.12 38.88 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 118.626 -0.702 . . . . 0.0 112.355 -169.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 55.19 46.69 23.29 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.657 0.783 . . . . 0.0 110.431 175.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -159.88 108.8 1.77 Allowed 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 -169.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -69.58 134.96 49.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.73 -64.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.612 0 N-CA-C 110.361 -1.096 . . . . 0.0 110.361 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.35 34.0 0.75 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.44 1.096 . . . . 0.0 111.253 176.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -87.01 55.05 3.4 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.843 0.857 . . . . 0.0 110.984 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -65.73 -57.42 8.07 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.995 1.718 . . . . 0.0 110.436 173.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -147.61 91.64 1.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.139 1.376 . . . . 0.0 108.364 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -69.84 121.74 17.88 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 169.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.4 tt -95.56 98.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 C-N-CA 125.762 1.625 . . . . 0.0 108.353 171.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.94 137.84 51.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 176.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 31.5 t -69.78 112.61 6.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 169.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -55.78 -46.22 78.0 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.04 0.936 . . . . 0.0 111.211 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.79 -62.23 1.94 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.796 1.238 . . . . 0.0 111.169 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.2 p -116.47 15.27 15.69 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.804 0.842 . . . . 0.0 112.949 -169.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.37 75.71 0.27 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 125.396 1.478 . . . . 0.0 112.803 168.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -135.09 125.93 27.4 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 124.558 1.143 . . . . 0.0 108.71 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -69.91 110.49 5.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.966 0.906 . . . . 0.0 110.033 173.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -117.79 144.43 45.35 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.272 1.429 . . . . 0.0 109.304 170.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.6 m80 -79.06 160.63 27.02 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 167.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.6 mt -55.01 -49.03 72.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.55 0.74 . . . . 0.0 109.75 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -46.96 -52.46 14.57 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.925 1.29 . . . . 0.0 112.13 170.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.5 m -67.54 -32.48 73.29 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.534 0.733 . . . . 0.0 111.342 -171.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.9 mt -64.22 -68.14 0.38 Allowed 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 169.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 89.9 mtm-85 -149.72 126.4 5.32 Favored Pre-proline 0 CA--C 1.533 0.327 0 C-N-CA 124.695 1.198 . . . . 0.0 107.959 -175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -57.65 -34.39 98.06 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.806 3.004 . . . . 0.0 112.71 -169.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.93 -22.06 66.93 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.409 1.084 . . . . 0.0 113.169 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.79 114.28 9.71 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.529 0.604 . . . . 0.0 109.639 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -110.89 -42.02 4.1 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.262 1.425 . . . . 0.0 109.398 169.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -102.78 168.18 9.4 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.146 1.378 . . . . 0.0 109.426 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 9.3 p -69.35 141.93 91.7 Favored Pre-proline 0 CA--C 1.537 0.456 0 C-N-CA 123.366 0.666 . . . . 0.0 110.459 -170.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -80.51 114.8 3.06 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 122.544 2.163 . . . . 0.0 108.609 169.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -77.2 70.34 3.58 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 169.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -170.4 -94.96 0.1 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -95.34 137.74 33.99 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.488 0.715 . . . . 0.0 110.049 -172.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -136.06 61.07 1.66 Allowed 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 124.428 1.091 . . . . 0.0 108.195 -171.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -146.36 171.31 15.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.806 1.242 . . . . 0.0 110.331 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.8 p -97.66 165.34 15.72 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.235 1.014 . . . . 0.0 110.275 176.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -55.64 -26.37 55.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.885 3.057 . . . . 0.0 114.901 176.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.17 -40.03 59.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.005 -175.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 83.7 m -66.86 -47.81 70.76 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.507 0.323 . . . . 0.0 110.455 169.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -69.93 159.41 84.27 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 124.277 1.031 . . . . 0.0 110.408 -172.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -68.99 72.51 1.07 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.044 1.829 . . . . 0.0 111.424 168.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.31 -178.34 6.26 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.025 1.33 . . . . 0.0 109.262 -169.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 116.883 -1.532 . . . . 0.0 108.876 -177.539 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 110.776 -0.083 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -150.03 127.81 11.73 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 170.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.4 t -69.74 135.12 49.38 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.04 0.536 . . . . 0.0 110.887 -169.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -54.84 -51.58 65.44 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.956 1.302 . . . . 0.0 110.791 173.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.0 t -65.64 -57.63 10.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 124.722 1.209 . . . . 0.0 110.207 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 m -77.18 -52.84 8.57 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.98 0.512 . . . . 0.0 110.704 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.2 mtp85 59.88 31.33 20.68 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.036 1.334 . . . . 0.0 111.426 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -108.94 142.38 39.65 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 124.842 1.257 . . . . 0.0 109.57 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -101.23 118.46 37.02 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.818 1.247 . . . . 0.0 107.861 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 163.14 -67.71 0.23 Allowed Glycine 0 C--N 1.335 0.507 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 -171.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.88 54.21 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.232 1.013 . . . . 0.0 110.779 178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.24 51.08 2.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.924 0.889 . . . . 0.0 108.929 -174.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -120.77 -80.62 0.63 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.821 1.248 . . . . 0.0 110.467 -169.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -97.47 60.74 1.62 Allowed 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.871 0.868 . . . . 0.0 110.047 -169.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.03 157.64 35.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.325 0.583 . . . . 0.0 110.464 169.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 tt -154.17 114.29 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 126.243 1.817 . . . . 0.0 107.818 175.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -90.02 147.76 23.48 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.106 0.962 . . . . 0.0 109.654 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.56 133.62 47.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 123.535 0.734 . . . . 0.0 110.158 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -57.14 -50.07 73.97 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.274 0.63 . . . . 0.0 111.263 178.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -63.77 -59.65 4.29 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.582 1.153 . . . . 0.0 111.761 -169.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.2 p -119.08 0.94 11.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.439 1.096 . . . . 0.0 113.646 -168.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 m120 61.07 34.02 19.33 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.919 0.888 . . . . 0.0 112.872 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -80.89 129.5 34.56 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.26 130.73 35.02 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.638 0.775 . . . . 0.0 110.013 -171.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -126.62 172.63 10.11 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.926 1.69 . . . . 0.0 108.394 172.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -111.21 168.39 9.55 Favored 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -60.11 -37.94 81.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 168.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.16 -51.47 32.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.138 1.375 . . . . 0.0 111.376 172.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.1 m -79.84 -39.38 30.78 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.606 1.162 . . . . 0.0 110.148 -169.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.37 -67.64 0.36 Allowed 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 125.883 1.673 . . . . 0.0 109.745 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -168.14 107.01 0.55 Allowed Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 125.531 1.532 . . . . 0.0 107.247 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -62.57 -15.37 45.54 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.886 3.057 . . . . 0.0 114.193 -169.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -53.88 -34.5 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.748 0.819 . . . . 0.0 112.519 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.82 135.68 43.47 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.056 0.542 . . . . 0.0 109.978 172.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -126.05 -34.38 2.56 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.152 1.381 . . . . 0.0 110.389 170.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -77.35 148.99 35.29 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.849 0.859 . . . . 0.0 109.317 168.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -79.92 131.14 64.41 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -85.97 90.01 0.71 Allowed 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.444 2.096 . . . . 0.0 108.212 169.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -77.29 64.6 2.72 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.907 0.883 . . . . 0.0 110.08 176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -144.01 -164.48 10.44 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.112 1.339 . . . . 0.0 109.916 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.43 128.97 38.24 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.286 0.634 . . . . 0.0 109.952 177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -151.62 149.25 28.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.911 0.885 . . . . 0.0 109.1 169.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -135.83 160.09 39.66 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.969 0.908 . . . . 0.0 110.399 169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.2 p -89.46 158.52 45.74 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.163 0.985 . . . . 0.0 111.064 -169.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -59.39 4.27 0.15 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 124.147 3.231 . . . . 0.0 116.656 169.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.35 -35.7 21.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.222 0.919 . . . . 0.0 110.241 169.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.4 m -75.69 -70.1 0.45 Allowed 'General case' 0 C--N 1.343 0.314 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -81.2 154.24 72.09 Favored Pre-proline 0 N--CA 1.452 -0.36 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 169.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -62.89 160.22 34.42 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 122.042 1.828 . . . . 0.0 112.619 169.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.45 77.0 1.92 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.565 169.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.6 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.976 173.273 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -155.46 143.45 19.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.5 t -69.77 144.66 52.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.426 0.69 . . . . 0.0 111.823 -169.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -65.58 -57.16 8.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.91 1.284 . . . . 0.0 110.564 171.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.8 t -59.95 -76.68 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.304 1.442 . . . . 0.0 111.274 -169.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.5 p -76.29 -41.3 49.19 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 117.808 0.276 . . . . 0.0 110.859 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 54.63 50.04 16.8 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.392 1.077 . . . . 0.0 110.623 -174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 62.8 mtpt -119.63 154.75 33.52 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 125.406 1.482 . . . . 0.0 108.297 171.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -119.95 175.28 5.98 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 123.84 0.856 . . . . 0.0 111.158 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.48 -55.88 0.56 Allowed Glycine 0 C--N 1.338 0.654 0 N-CA-C 107.447 -2.261 . . . . 0.0 107.447 -169.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.35 47.96 0.61 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.187 1.395 . . . . 0.0 111.561 169.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -77.84 66.07 3.42 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 124.903 1.281 . . . . 0.0 109.085 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -114.76 -50.62 2.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.418 1.487 . . . . 0.0 110.253 -169.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -155.84 74.97 0.89 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.854 0.862 . . . . 0.0 110.918 -172.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.27 88.28 3.7 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.84 122.03 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 123.944 0.897 . . . . 0.0 109.831 171.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -90.38 138.44 31.54 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 169.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -69.73 122.75 19.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 169.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -55.81 -45.67 78.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.765 0.826 . . . . 0.0 111.173 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -65.22 -60.74 2.67 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.595 1.158 . . . . 0.0 111.277 -169.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -111.43 3.37 18.1 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.793 0.837 . . . . 0.0 113.244 -169.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 61.62 58.6 2.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.363 1.065 . . . . 0.0 111.426 169.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -122.83 121.87 37.29 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.018 1.327 . . . . 0.0 108.869 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.16 134.82 36.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.305 1.042 . . . . 0.0 110.608 -175.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -151.05 151.97 32.79 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 126.265 1.826 . . . . 0.0 107.671 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -89.25 157.84 18.08 Favored 'General case' 0 C--O 1.23 0.029 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 167.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.84 -35.67 75.25 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.133 0.173 . . . . 0.0 110.696 169.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -51.58 -56.56 12.82 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.025 0.93 . . . . 0.0 110.933 169.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 62.0 m -74.72 -29.96 61.35 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.811 1.244 . . . . 0.0 110.997 -169.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tt -60.88 -68.39 0.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.36 1.064 . . . . 0.0 108.394 169.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 40.2 ttp180 -170.45 108.94 0.43 Allowed Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.622 1.169 . . . . 0.0 108.061 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -60.68 -33.51 93.19 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 123.239 2.626 . . . . 0.0 112.793 -169.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -48.42 -41.52 29.44 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.178 0.991 . . . . 0.0 112.114 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.29 80.09 4.71 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 168.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -69.73 -41.82 74.78 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.191 0.596 . . . . 0.0 109.629 169.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 21.9 mp0 -80.51 165.64 21.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.107 1.363 . . . . 0.0 109.555 169.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.62 141.47 95.26 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 123.815 0.846 . . . . 0.0 109.658 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.33 99.0 1.2 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.29 1.993 . . . . 0.0 107.548 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -82.76 58.78 4.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.043 0.537 . . . . 0.0 110.413 -169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.92 -69.45 0.06 OUTLIER Glycine 0 C--N 1.338 0.661 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 41' ' ' GLU . 0.8 OUTLIER -85.59 68.38 10.4 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 109.814 173.188 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -70.09 76.34 0.5 Allowed 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.298 1.039 . . . . 0.0 108.88 169.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -141.6 166.22 25.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.622 1.169 . . . . 0.0 110.416 -168.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.9 p -93.57 148.76 36.04 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -65.57 -13.46 39.92 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 123.203 2.602 . . . . 0.0 113.676 -168.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -42.76 89.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.534 0.734 . . . . 0.0 110.376 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.94 -38.2 69.86 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 123.133 0.573 . . . . 0.0 111.556 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -69.07 110.92 6.98 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.562 0.745 . . . . 0.0 110.045 -169.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.77 -48.02 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 122.376 2.051 . . . . 0.0 110.462 -172.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.77 59.14 0.54 Allowed 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.682 1.193 . . . . 0.0 108.358 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.993 1.317 . . . . 0.0 109.069 -177.705 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -80.91 -179.96 7.56 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.793 0.437 . . . . 0.0 111.065 169.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.15 163.73 16.2 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.88 1.272 . . . . 0.0 111.316 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -74.31 -51.28 15.67 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.815 1.246 . . . . 0.0 110.005 169.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -72.66 -80.08 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 125.166 1.386 . . . . 0.0 109.519 -169.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.5 p -73.14 -22.22 60.57 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.264 0.626 . . . . 0.0 112.029 -174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . 0.255 9.1 ptp180 48.17 56.64 7.07 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.742 2.017 . . . . 0.0 114.008 169.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 51.9 mttp -132.43 138.91 47.81 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 125.539 1.536 . . . . 0.0 107.159 169.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.8 ttpp -81.26 59.44 3.95 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 169.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -103.31 -72.26 0.9 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -171.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.6 mp0 -87.58 69.91 9.75 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -174.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -73.1 67.13 0.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.346 1.058 . . . . 0.0 109.541 172.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -111.84 -80.41 0.59 Allowed 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.425 1.49 . . . . 0.0 109.462 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -146.12 70.58 1.23 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.8 1.24 . . . . 0.0 108.397 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.17 123.06 24.58 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.943 0.401 . . . . 0.0 110.177 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 tt -78.57 103.61 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 124.899 1.28 . . . . 0.0 107.592 169.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.5 mt -76.8 152.8 35.4 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 169.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 37.3 t -86.25 123.42 31.49 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.412 172.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -54.02 -55.28 28.73 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.738 1.215 . . . . 0.0 111.871 173.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -56.08 -62.44 1.71 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.506 1.522 . . . . 0.0 112.246 -169.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.9 p -120.6 9.73 10.9 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -169.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 59.43 73.86 0.47 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.189 0.904 . . . . 0.0 111.168 169.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -138.15 132.08 31.38 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.606 1.562 . . . . 0.0 108.351 -178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -91.22 128.22 36.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.874 0.87 . . . . 0.0 109.978 -170.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -134.84 150.06 50.43 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 124.405 1.082 . . . . 0.0 109.318 176.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -86.29 153.23 22.13 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.5 mt -55.97 -40.75 73.71 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.699 0.4 . . . . 0.0 110.005 169.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -46.62 -53.55 11.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.844 1.658 . . . . 0.0 111.569 171.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 68.1 m -69.98 -31.66 69.47 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.871 0.869 . . . . 0.0 110.705 -170.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.63 -68.46 0.39 Allowed 'General case' 0 C--N 1.341 0.219 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 169.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -170.46 132.78 0.98 Allowed Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 125.479 1.511 . . . . 0.0 109.208 169.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -64.95 -20.2 64.14 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 123.802 3.001 . . . . 0.0 112.5 -171.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.75 -33.14 15.35 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.702 1.201 . . . . 0.0 112.806 169.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.14 89.56 0.64 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 108.48 -0.934 . . . . 0.0 108.48 169.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.96 -43.15 59.17 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.184 0.594 . . . . 0.0 110.56 178.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -111.57 173.35 6.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.256 1.422 . . . . 0.0 110.377 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.9 t -82.82 131.79 53.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 124.058 0.943 . . . . 0.0 109.256 -170.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -86.32 84.15 1.14 Allowed 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.269 1.979 . . . . 0.0 108.42 169.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -73.3 65.96 0.89 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 169.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -163.98 -66.38 0.02 OUTLIER Glycine 0 CA--C 1.524 0.628 0 N-CA-C 106.78 -2.528 . . . . 0.0 106.78 -179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -85.46 53.47 2.77 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 169.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -88.94 63.97 6.98 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.739 0.816 . . . . 0.0 109.751 -169.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -134.98 -179.71 5.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.199 1.399 . . . . 0.0 110.29 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 28.5 p -118.4 157.57 49.0 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.206 1.002 . . . . 0.0 111.384 176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -56.2 -21.33 35.23 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 124.67 3.58 . . . . 0.0 115.81 169.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.47 -30.3 69.97 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.889 0.768 . . . . 0.0 110.293 177.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 60.5 m -72.25 -58.31 3.52 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -132.53 92.21 28.27 Favored Pre-proline 0 CA--C 1.532 0.265 0 C-N-CA 124.474 1.109 . . . . 0.0 108.665 -170.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -77.3 171.54 17.56 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.841 2.361 . . . . 0.0 110.644 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.7 142.05 57.55 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.057 0.543 . . . . 0.0 109.907 169.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 117.071 -1.442 . . . . 0.0 108.244 178.976 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 110.65 -0.13 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.54 174.11 5.31 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.832 0.453 . . . . 0.0 111.825 174.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.8 t -133.73 152.54 51.9 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.163 1.385 . . . . 0.0 109.087 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -51.42 63.17 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.651 0.781 . . . . 0.0 110.219 172.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.23 -72.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 125.216 1.407 . . . . 0.0 109.726 -169.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.7 p -83.51 -24.49 31.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.159 -169.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.14 50.15 18.42 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 124.324 1.05 . . . . 0.0 110.31 -171.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -118.06 159.43 23.23 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.229 1.011 . . . . 0.0 109.416 170.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.4 109.1 7.5 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 169.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.78 -60.52 0.08 OUTLIER Glycine 0 C--N 1.338 0.651 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -169.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.27 46.78 0.64 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.81 0.844 . . . . 0.0 110.883 171.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -89.95 62.21 5.55 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.273 0.629 . . . . 0.0 109.35 -169.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.46 -70.38 0.26 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.298 1.039 . . . . 0.0 109.667 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -150.59 87.09 1.41 Allowed 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 125.095 1.358 . . . . 0.0 107.522 -170.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.75 116.27 9.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 5.2 tt -75.02 86.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 C-N-CA 124.081 0.953 . . . . 0.0 108.736 169.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.8 mt -69.55 122.58 19.34 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 169.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.62 114.25 7.66 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.448 0.699 . . . . 0.0 109.406 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -59.35 -45.64 90.82 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.814 0.845 . . . . 0.0 111.019 -177.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -58.55 -60.85 3.15 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.61 1.164 . . . . 0.0 111.342 -169.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.3 p -120.2 8.85 10.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.07 0.948 . . . . 0.0 112.999 -169.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.8 m120 60.78 74.93 0.43 Allowed 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.587 1.155 . . . . 0.0 112.474 168.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.6 mmtm -137.28 128.9 28.57 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.496 1.518 . . . . 0.0 108.722 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.45 132.63 35.21 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 124.134 0.974 . . . . 0.0 110.199 -176.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -146.66 139.83 25.53 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.366 1.066 . . . . 0.0 109.272 178.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -78.52 156.05 29.46 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 167.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.19 -43.96 83.18 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 117.96 0.345 . . . . 0.0 110.99 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -54.4 -49.9 68.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.132 0.973 . . . . 0.0 110.945 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.7 m -69.74 -30.88 68.59 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.511 0.725 . . . . 0.0 111.081 -175.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.64 -65.57 0.65 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.229 1.012 . . . . 0.0 109.386 171.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -147.49 134.0 9.86 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 125.475 1.51 . . . . 0.0 107.603 169.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -59.29 -31.94 95.96 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 123.079 2.519 . . . . 0.0 111.792 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.87 -33.74 72.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.66 1.184 . . . . 0.0 113.266 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -75.22 120.24 20.45 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.118 0.417 . . . . 0.0 109.991 -178.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -117.13 -13.96 10.54 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.646 1.578 . . . . 0.0 110.406 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.81 156.66 43.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.351 2.26 . . . . 0.0 108.675 -175.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 81.9 t -75.41 134.16 73.61 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 123.021 0.529 . . . . 0.0 110.112 -169.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -83.42 106.66 1.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.178 1.918 . . . . 0.0 107.817 168.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -82.55 61.11 5.52 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.307 0.643 . . . . 0.0 110.284 -172.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.37 -56.87 0.05 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 108.832 -1.707 . . . . 0.0 108.832 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -84.79 62.82 7.64 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.073 0.949 . . . . 0.0 109.864 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -80.72 69.45 7.26 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.225 1.01 . . . . 0.0 109.647 177.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -143.61 -179.85 6.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.378 1.071 . . . . 0.0 110.314 -172.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 30.0 p -116.51 162.34 27.21 Favored Pre-proline 0 CA--C 1.538 0.498 0 C-N-CA 124.123 0.969 . . . . 0.0 110.198 169.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -52.97 -19.64 11.8 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 124.562 3.508 . . . . 0.0 116.17 174.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.13 -35.26 77.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.827 0.74 . . . . 0.0 110.945 176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.8 m -72.56 -55.86 6.26 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.751 0.42 . . . . 0.0 110.376 -170.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.61 161.47 74.04 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.972 0.909 . . . . 0.0 110.865 170.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -84.52 -52.99 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.934 2.423 . . . . 0.0 110.784 169.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.09 151.99 18.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.336 1.054 . . . . 0.0 108.969 -175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 47.0 p . . . . . 0 C--O 1.252 1.185 0 CA-C-O 116.885 -1.531 . . . . 0.0 109.229 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.159 0.028 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -74.13 103.47 4.59 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.057 0.543 . . . . 0.0 110.201 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -69.05 145.01 53.86 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.824 1.25 . . . . 0.0 108.928 169.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.76 -38.74 80.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.283 0.633 . . . . 0.0 111.612 -169.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.46 -65.86 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.239 1.016 . . . . 0.0 110.142 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.3 p -78.33 -7.54 57.38 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.689 -0.672 . . . . 0.0 112.61 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 ptp85 43.82 46.68 6.66 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 126.449 1.9 . . . . 0.0 112.337 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -169.53 149.91 4.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.774 1.229 . . . . 0.0 107.903 -169.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -69.43 131.99 45.64 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 169.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.42 5.81 Favored Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 -169.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -73.9 88.63 1.84 Allowed 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 169.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -82.59 65.15 7.58 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.793 0.837 . . . . 0.0 109.524 -171.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.12 -70.95 0.19 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 109.735 171.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -148.82 92.01 1.94 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.977 1.311 . . . . 0.0 107.481 -173.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mp -71.5 86.93 0.88 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 169.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.6 tt -69.56 119.89 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 169.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.22 131.44 35.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 169.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.4 t -67.26 127.19 31.7 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -57.6 -45.96 84.65 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.401 0.68 . . . . 0.0 110.607 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.98 -62.68 1.41 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.712 1.205 . . . . 0.0 111.114 -172.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.0 p -102.01 -6.91 22.83 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 62.03 66.29 0.83 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.391 1.076 . . . . 0.0 111.027 174.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -136.38 130.22 32.44 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 124.897 1.279 . . . . 0.0 109.012 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.7 126.51 30.83 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.479 1.112 . . . . 0.0 110.601 -171.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -139.38 123.12 17.53 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.349 1.46 . . . . 0.0 108.165 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.2 m80 -65.71 146.86 54.27 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 168.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.12 -35.19 69.17 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.305 0.502 . . . . 0.0 111.212 169.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -52.16 -51.26 59.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.78 0.832 . . . . 0.0 112.118 169.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.51 -37.35 84.85 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.951 0.9 . . . . 0.0 110.978 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.0 -72.55 0.38 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 109.391 -172.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -151.57 97.23 3.12 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 126.493 1.917 . . . . 0.0 107.648 -178.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -62.73 -34.65 72.68 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.845 2.363 . . . . 0.0 111.569 -170.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -50.56 -38.28 44.29 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 125.032 1.333 . . . . 0.0 112.95 172.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.25 82.3 6.33 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 169.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -69.91 -22.66 63.19 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.631 0.772 . . . . 0.0 112.263 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -119.26 168.73 10.61 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.504 1.122 . . . . 0.0 109.802 169.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.02 131.5 93.79 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 123.975 0.91 . . . . 0.0 110.065 -169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -80.81 98.54 1.07 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.286 1.991 . . . . 0.0 108.236 169.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -76.0 67.93 2.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.84 0.856 . . . . 0.0 109.809 174.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 176.77 -65.1 0.09 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.514 -1.835 . . . . 0.0 108.514 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -85.19 54.24 3.03 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.355 1.062 . . . . 0.0 109.045 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -85.44 62.86 7.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.223 1.009 . . . . 0.0 110.167 -169.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -144.31 137.04 26.91 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.706 1.202 . . . . 0.0 108.868 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.1 p -71.34 158.51 87.86 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.573 1.149 . . . . 0.0 109.774 169.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -42.55 -42.65 8.31 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 125.212 3.942 . . . . 0.0 116.317 -168.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.34 -42.51 65.29 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.345 0.658 . . . . 0.0 110.081 -174.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.5 m -69.01 -34.91 76.03 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.337 1.055 . . . . 0.0 111.512 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -69.44 133.46 89.1 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 124.945 1.298 . . . . 0.0 109.073 -171.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -59.22 129.31 30.96 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.638 2.225 . . . . 0.0 112.213 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.46 153.96 35.65 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.291 1.037 . . . . 0.0 109.12 169.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.268 -1.349 . . . . 0.0 108.356 177.678 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 tpp85 -145.63 142.54 29.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.205 1.002 . . . . 0.0 109.11 -177.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -69.2 151.61 46.1 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.401 1.88 . . . . 0.0 111.65 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -66.37 -58.82 4.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.832 1.253 . . . . 0.0 111.439 173.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.6 t -50.84 -68.56 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 125.965 1.706 . . . . 0.0 111.414 -169.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.5 p -81.13 -54.41 5.55 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.008 0.523 . . . . 0.0 110.459 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ttm180 62.85 -0.23 0.6 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.667 1.587 . . . . 0.0 114.393 -174.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -142.03 65.72 1.36 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -170.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -152.25 123.43 7.64 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 -169.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.41 76.57 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.886 0.755 . . . . 0.0 111.956 -173.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -77.7 69.1 3.9 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.121 1.368 . . . . 0.0 110.238 -171.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -81.89 60.25 4.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.274 0.63 . . . . 0.0 109.59 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.89 -65.01 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 125.222 1.409 . . . . 0.0 108.843 -170.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -130.71 78.32 1.84 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.228 1.411 . . . . 0.0 107.932 -171.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.4 mp -75.54 163.0 27.81 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.555 0.693 . . . . 0.0 110.273 169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 tt -159.11 109.89 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 125.403 1.481 . . . . 0.0 107.139 -171.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.9 mt -74.54 151.39 39.48 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.98 0.912 . . . . 0.0 109.763 171.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.2 t -69.8 140.08 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 169.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -57.21 -46.56 82.81 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.447 0.699 . . . . 0.0 111.294 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -82.8 -66.55 0.88 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.203 1.401 . . . . 0.0 110.371 -169.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 26.6 p -96.89 -3.6 41.63 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 -169.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t30 56.83 47.26 18.31 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.867 0.867 . . . . 0.0 111.433 169.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -101.69 136.01 42.25 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.338 1.455 . . . . 0.0 108.581 171.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.52 137.51 35.56 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.486 0.714 . . . . 0.0 110.427 -170.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -139.37 165.73 26.42 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.172 1.389 . . . . 0.0 109.543 175.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -107.01 155.97 19.24 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 167.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.1 mt -57.45 -41.51 80.69 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 169.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -43.66 -51.93 6.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.991 1.716 . . . . 0.0 112.121 170.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 63.8 m -76.62 -36.2 57.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.708 0.803 . . . . 0.0 110.631 -171.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.83 -69.05 0.57 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 123.611 0.764 . . . . 0.0 111.329 -178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 78.3 mmt-85 -143.52 83.18 10.92 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 125.945 1.698 . . . . 0.0 107.448 -169.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -61.08 -29.3 87.21 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.084 2.523 . . . . 0.0 112.811 -169.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.06 69.77 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.334 1.053 . . . . 0.0 112.759 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 tp -77.57 113.96 15.92 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -95.99 -34.48 11.76 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.088 0.955 . . . . 0.0 111.512 -171.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -96.89 157.67 15.79 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 -177.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.55 134.49 84.28 Favored Pre-proline 0 CA--C 1.536 0.415 0 C-N-CA 123.656 0.782 . . . . 0.0 109.454 -177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -86.13 113.56 1.24 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.924 2.416 . . . . 0.0 108.937 169.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -75.17 67.59 1.83 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.296 1.038 . . . . 0.0 110.4 169.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.04 172.96 34.64 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 175.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -80.88 83.75 6.54 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.582 1.153 . . . . 0.0 109.743 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -76.33 112.76 13.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.76 0.424 . . . . 0.0 111.487 -170.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -78.38 127.72 32.61 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 168.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 13.8 p -83.72 173.13 7.83 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.77 0.828 . . . . 0.0 110.019 -175.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -54.25 -27.81 49.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.803 3.002 . . . . 0.0 115.554 -177.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.38 69.07 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.187 0.449 . . . . 0.0 110.227 173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 59.0 m -81.07 -50.99 8.98 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.156 0.582 . . . . 0.0 111.058 -169.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -69.99 147.32 95.8 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.855 0.862 . . . . 0.0 110.714 -169.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -75.73 171.23 18.58 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.365 2.71 . . . . 0.0 110.726 177.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.61 58.45 4.59 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.982 0.913 . . . . 0.0 110.496 -175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.252 1.234 0 C-N-CA 125.337 1.455 . . . . 0.0 109.349 179.774 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 119.449 -0.31 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.8 128.54 36.75 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.252 0.621 . . . . 0.0 109.35 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.3 t -154.33 137.12 15.3 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.896 -1.149 . . . . 0.0 107.896 -173.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.87 -51.93 62.08 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.045 0.938 . . . . 0.0 110.209 179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 79.9 t -69.35 -69.95 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.618 1.167 . . . . 0.0 110.452 -169.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 28.9 p -96.06 -38.76 10.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.165 0.586 . . . . 0.0 112.291 -169.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 51.76 57.77 6.19 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.806 1.242 . . . . 0.0 111.326 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -112.65 116.43 30.14 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 123.848 0.859 . . . . 0.0 109.83 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -81.89 121.86 27.02 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 168.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.09 -63.33 0.32 Allowed Glycine 0 C--N 1.334 0.452 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -169.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.48 59.54 2.42 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.748 0.819 . . . . 0.0 109.263 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.58 58.01 4.79 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -84.46 -80.13 0.2 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.616 1.166 . . . . 0.0 111.161 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.48 72.6 0.75 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.711 0.804 . . . . 0.0 109.951 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 mp -69.77 156.69 38.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.123 0.487 . . . . 0.0 110.987 -170.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.8 125.69 73.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 C-N-CA 125.711 1.604 . . . . 0.0 108.777 -176.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.1 mp -98.5 137.54 37.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 169.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.8 t -69.36 139.78 54.21 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.529 0.331 . . . . 0.0 110.224 -169.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -59.42 -43.64 93.03 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.477 0.711 . . . . 0.0 110.987 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -75.52 -58.73 3.11 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.546 1.138 . . . . 0.0 111.073 -172.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.1 p -119.55 10.63 11.85 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.6 t30 66.93 7.09 5.08 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 169.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -68.98 132.1 46.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.452 -0.78 . . . . 0.0 109.832 -176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.01 144.72 29.76 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.917 0.887 . . . . 0.0 110.528 -172.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -160.29 156.52 26.52 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.641 1.176 . . . . 0.0 109.822 -169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -95.64 149.43 21.47 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 168.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -56.3 -43.72 79.19 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 169.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -51.38 -56.12 14.9 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.231 1.412 . . . . 0.0 110.754 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 72.6 m -70.02 -29.69 66.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.016 0.926 . . . . 0.0 110.925 -169.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.3 mt -67.41 -71.38 0.21 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 122.843 0.457 . . . . 0.0 110.158 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -130.5 119.53 18.44 Favored Pre-proline 0 CA--C 1.534 0.35 0 C-N-CA 124.973 1.309 . . . . 0.0 108.269 179.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -59.39 -38.41 84.32 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.014 2.476 . . . . 0.0 111.782 -171.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.04 -26.82 66.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.31 1.044 . . . . 0.0 112.872 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.06 114.36 15.78 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 170.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -106.78 -51.11 2.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.775 1.23 . . . . 0.0 108.432 169.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -81.45 167.36 19.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.536 1.135 . . . . 0.0 110.198 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.2 m -68.11 156.19 90.38 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 123.762 0.825 . . . . 0.0 111.088 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.59 163.39 26.8 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.04 2.494 . . . . 0.0 110.138 169.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -84.31 49.47 1.67 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.755 1.222 . . . . 0.0 110.958 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.01 -175.1 39.39 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -63.81 159.09 20.23 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.026 0.931 . . . . 0.0 110.332 169.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 66.2 t-105 -145.01 113.37 6.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.404 0.682 . . . . 0.0 109.518 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -70.0 132.93 46.68 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.794 0.838 . . . . 0.0 109.473 170.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 23.4 p -77.56 162.63 67.78 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.906 1.282 . . . . 0.0 109.748 -174.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.95 -3.21 10.12 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.115 2.543 . . . . 0.0 113.963 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.38 -37.09 57.7 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.802 0.728 . . . . 0.0 109.542 169.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 33.0 m -72.55 -57.85 3.83 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.545 0.738 . . . . 0.0 110.465 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -77.08 162.12 70.89 Favored Pre-proline 0 N--CA 1.451 -0.396 0 C-N-CA 123.622 0.769 . . . . 0.0 110.605 -169.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -62.06 107.06 0.51 Allowed 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.544 2.163 . . . . 0.0 111.315 169.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.91 69.05 2.5 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.939 0.895 . . . . 0.0 109.836 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.252 1.186 0 CA-C-O 116.964 -1.493 . . . . 0.0 108.648 -169.909 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_